Crystallography Open Database

Information card for entry 7215968

Preview

Coordinates	7215968.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C74 H88 Cd2 N12 O10
Calculated formula	C74 H84 Cd2 N12 O10
Title of publication	A novel 3D 10-fold interpenetrated homochiral coordination polymer: large spontaneous polarization, dielectric loss and emission studies
Authors of publication	Ahmad, Musheer; Katoch, Rajesh; Garg, Ashish; Bharadwaj, Parimal K.
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	22
Pages of publication	4766
a	8.5561 ± 0.0017 Å
b	8.656 ± 0.0018 Å
c	24.424 ± 0.005 Å
α	93.654 ± 0.003°
β	95.997 ± 0.003°
γ	91.067 ± 0.004°
Cell volume	1794.7 ± 0.6 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	1
Hermann-Mauguin space group symbol	P 1
Hall space group symbol	P 1
Residual factor for all reflections	0.0762
Residual factor for significantly intense reflections	0.0614
Weighted residual factors for significantly intense reflections	0.1382
Weighted residual factors for all reflections included in the refinement	0.1495
Goodness-of-fit parameter for all reflections included in the refinement	1.024
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
180490 (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 7/21/59.	7215968.cif
113865	2014-05-16	cif/ Adding structures of 7215968 via cif-deposit CGI script.	7215968.cif