Crystallography Open Database

Information card for entry 1529675

Preview

Coordinates	1529675.cif

Structure parameters

Chemical name	((N H2 C O N H2)6 Cr) (Co (N H3)2 (N O2)4)3 (H2 O)3
Formula	C6 H24 Co3 Cr N30 O33
Calculated formula	C6 H48 Co3 Cr N30 O33
SMILES	C(N)(N)=[O][Cr]([O]=C(N)N)([O]=C(N)N)([O]=C(N)N)([O]=C(N)N)[O]=C(N)N.[NH3][Co](N(=O)=O)(N(=O)=O)(N(=O)=O)([NH3])N(=O)=O.O.O=N(=O)[Co]([NH3])([NH3])(N(=O)=O)(N(=O)=O)N(=O)=O.[NH3][Co](N(=O)=O)(N(=O)=O)(N(=O)=O)([NH3])N(=O)=O.O.O
Title of publication	The crystal structure of the complex compound (Cr (O C N2 H4)6) (Co (N H3)2 (N O2)4)3 (H2 O)3
Authors of publication	Bondar, V.I.; Belov, N.V.; Kurkutova, E.N.; Ilyukhin, V.V.; Rau, V.G.
Journal of publication	Doklady Akademii Nauk SSSR
Year of publication	1979
Journal volume	244
Pages of publication	358 - 361
a	24.78 Å
b	24.78 Å
c	13.195 Å
α	90°
β	90°
γ	120°
Cell volume	7016.86 Å³
Number of distinct elements	6
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
186594 (current)	2016-09-16	cif/1/ Adding attached hydrogens to N and O atoms.	1529675.cif
176429	2016-02-13	cif/ (antanas@kurmis) Replacing _cod_chemical_formula_sum_orig tag with _cod_original_formula_sum tag in multiple entries since the replaced tag is deprecated according to the COD CIF dictionary.	1529675.cif
154163	2015-09-04	cif/ Adding structures of 1529675 via cif-deposit CGI script.	1529675.cif