Crystallography Open Database

Information card for entry 7232432

Preview

Coordinates	7232432.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27.5 H22 N3 O5 V0.5
Calculated formula	C27.5 H22 N3 O5 V0.5
Title of publication	Robust and electron deficient oxidovanadium(iv) porphyrin catalysts for selective epoxidation and oxidative bromination reactions in aqueous media
Authors of publication	Dar, Tawseef Ahmad; Uprety, Bhawna; Sankar, Muniappan; Maurya, Mannar R.
Journal of publication	Green Chemistry
Year of publication	2019
Journal volume	21
Journal issue	7
Pages of publication	1757
a	13.829 ± 0.005 Å
b	14.439 ± 0.005 Å
c	26.153 ± 0.005 Å
α	90 ± 0.005°
β	90 ± 0.005°
γ	90 ± 0.005°
Cell volume	5222 ± 3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	56
Hermann-Mauguin space group symbol	P c c n
Hall space group symbol	-P 2ab 2ac
Residual factor for all reflections	0.2466
Residual factor for significantly intense reflections	0.1927
Weighted residual factors for significantly intense reflections	0.5193
Weighted residual factors for all reflections included in the refinement	0.5556
Goodness-of-fit parameter for all reflections included in the refinement	2.181
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
224622 (current)	2019-11-08	cif/ Updating files of 7232431, 7232432 Original log message: Adding full bibliography for 7232431--7232432.cif.	7232432.cif
213781	2019-02-22	cif/ Adding structures of 7232431, 7232432 via cif-deposit CGI script.	7232432.cif