Crystallography Open Database

Information card for entry 7216090

Preview

Coordinates	7216090.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H24 Cu2 N5 O11 P3 V
Calculated formula	C30 H23 Cu2 N5 O11 P3 V
Title of publication	Secondary metal‒ligand cationic subunits {ML}n+ as structural determinants in the oxovanadium/phenylphosphonate/{ML}n+ system, where {ML} is a Cu2+/organonitrogen moiety
Authors of publication	Yucesan, Gundog; Yu, Ming Hui; Ouellette, Wayne; O'Connor, Charles J.; Zubieta, Jon
Journal of publication	CrystEngComm
Year of publication	2005
Journal volume	7
Journal issue	80
Pages of publication	480
a	13.4837 ± 0.0013 Å
b	13.7172 ± 0.0013 Å
c	18.9414 ± 0.0018 Å
α	90°
β	87.155 ± 0.003°
γ	90°
Cell volume	3499.1 ± 0.6 Å³
Cell temperature	93 ± 2 K
Ambient diffraction temperature	93 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0878
Residual factor for significantly intense reflections	0.0638
Weighted residual factors for significantly intense reflections	0.1098
Weighted residual factors for all reflections included in the refinement	0.1291
Goodness-of-fit parameter for all reflections included in the refinement	1.062
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
180491 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/60.	7216090.cif
114338	2014-05-23	cif/ Adding structures of 7216090, 7216091, 7216092, 7216093, 7216094 via cif-deposit CGI script.	7216090.cif