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Results for cif 1471 to 1485 of 3458 results.
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Igeom_hbond_distance_.html: Index Core dictionary (coreCIF) version 2.4.5 _geom_hbond_distance_ Names: '_geom_hbond_distance_DH' '_geom_hbond_distance_HA' '_geom_hbond_distance_DA' Definition: Distances in angstroms between the donor and hydrogen (*_DH), hydrogen and acceptor (*_HA) and donor and acceptor (*_DA) sites in a hydrogen bond. Appears in list containing _geom ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_core.dic/Igeom_hbond_distance_.html

Igeom_hbond_atom_site_label_.html: Index Core dictionary (coreCIF) version 2.4.5 _geom_hbond_atom_site_label_ Names: '_geom_hbond_atom_site_label_D' '_geom_hbond_atom_site_label_H' '_geom_hbond_atom_site_label_A' Definition: The labels of three atom sites (respectively, the donor atom, hydrogen atom and acceptor atom) participating in a hydrogen bond. ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_core.dic/Igeom_hbond_atom_site_label_.html

Igeom_hbond_angle_DHA.html: Index Core dictionary (coreCIF) version 2.4.5 _geom_hbond_angle_DHA Name: '_geom_hbond_angle_DHA' Definition: Angle in degrees defined by the three sites _geom_hbond_atom_site_label_D, *_H and *_A. The site at *_H (the hydrogen atom participating in the interaction) is at the apex of the angle. ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_core.dic/Igeom_hbond_angle_DHA.html

Cgeom_hbond.html: Index Core dictionary (coreCIF) version 2.4.5 Category GEOM_HBOND Name: '_geom_hbond_[]' Definition: Data items in the GEOM_HBOND category record details about hydrogen bonds as calculated from the ATOM, CELL and SYMMETRY data. Example: Example 1 - based on C~14~H~13~ClN~2~O.H~2~O, reported by Palmer ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_core.dic/Cgeom_hbond.html

Igeom_contact_site_symmetry_.html: Index Core dictionary (coreCIF) version 2.4.5 _geom_contact_site_symmetry_ Names: '_geom_contact_site_symmetry_1' '_geom_contact_site_symmetry_2' Definition: The symmetry code of each atom site as the symmetry-equivalent position number 'n' and the cell translation number 'klm'. These numbers are combined to form the code ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_core.dic/Igeom_contact_site_symmetry_.html

Igeom_contact_publ_flag.html: Index Core dictionary (coreCIF) version 2.4.5 _geom_contact_publ_flag Name: '_geom_contact_publ_flag' Definition: This code signals whether the contact distance is referred to in a publication or should be placed in a list of significant contact distances. Appears in list containing _geom_contact_atom_site_label_ The data ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_core.dic/Igeom_contact_publ_flag.html

Igeom_contact_distance.html: Index Core dictionary (coreCIF) version 2.4.5 _geom_contact_distance Name: '_geom_contact_distance' Definition: The interatomic contact distance in angstroms. Appears in list containing _geom_contact_atom_site_label_ The permitted range is 0.0 -> infinity Type: numb Category: geom_contact...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_core.dic/Igeom_contact_distance.html

Igeom_contact_atom_site_label_.html: Index Core dictionary (coreCIF) version 2.4.5 _geom_contact_atom_site_label_ Names: '_geom_contact_atom_site_label_1' '_geom_contact_atom_site_label_2' Definition: The labels of two atom sites that are within contact distance. The labels must match _atom_site_label codes in the atom list. Appears in list ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_core.dic/Igeom_contact_atom_site_label_.html

Cgeom_contact.html: Index Core dictionary (coreCIF) version 2.4.5 Category GEOM_CONTACT Name: '_geom_contact_[]' Definition: Data items in the GEOM_CONTACT category record details about interatomic contacts as calculated from the ATOM, CELL and SYMMETRY data. Example: Example 1 - based on data set CLPHO6 of Ferguson, Ruhl, McKervey & Browne [Acta Cryst. (1992), C48 ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_core.dic/Cgeom_contact.html

Igeom_bond_valence.html: Index Core dictionary (coreCIF) version 2.4.5 _geom_bond_valence Name: '_geom_bond_valence' Definition: The bond valence calculated from _geom_bond_distance. Appears in list containing _geom_bond_atom_site_label_ Type: numb Category: geom_bond...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_core.dic/Igeom_bond_valence.html

Igeom_bond_site_symmetry_.html: Index Core dictionary (coreCIF) version 2.4.5 _geom_bond_site_symmetry_ Names: '_geom_bond_site_symmetry_1' '_geom_bond_site_symmetry_2' Definition: The symmetry code of each atom site as the symmetry-equivalent position number 'n' and the cell translation number 'klm'. These numbers are combined to form the code ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_core.dic/Igeom_bond_site_symmetry_.html

Igeom_bond_publ_flag.html: Index Core dictionary (coreCIF) version 2.4.5 _geom_bond_publ_flag Name: '_geom_bond_publ_flag' Definition: This code signals whether the bond distance is referred to in a publication or should be placed in a list of significant bond distances. Appears in list containing _geom_bond_atom_site_label_ The data ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_core.dic/Igeom_bond_publ_flag.html

Igeom_bond_multiplicity.html: Index Core dictionary (coreCIF) version 2.4.5 _geom_bond_multiplicity Name: '_geom_bond_multiplicity' Definition: The number of times the given bond appears in the environment of the atoms labelled _geom_bond_atom_site_label_1. In cases where the full list of bonds is given, one of the series of equivalent ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_core.dic/Igeom_bond_multiplicity.html

Igeom_bond_distance.html: Index Core dictionary (coreCIF) version 2.4.5 _geom_bond_distance Name: '_geom_bond_distance' Definition: The intramolecular bond distance in angstroms. Appears in list containing _geom_bond_atom_site_label_ The permitted range is 0.0 -> infinity Type: numb Category: geom_bond...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_core.dic/Igeom_bond_distance.html

Igeom_bond_atom_site_label_.html: Index Core dictionary (coreCIF) version 2.4.5 _geom_bond_atom_site_label_ Names: '_geom_bond_atom_site_label_1' '_geom_bond_atom_site_label_2' Definition: The labels of two atom sites that form a bond. These must match labels specified as _atom_site_label in the atom list. Appears in list ... ...

Document Title: CIF dictionaries
Document Path: /__data/iucr/cifdic_html/1/cif_core.dic/Igeom_bond_atom_site_label_.html

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