Crystallography Open Database

Information card for entry 7207555

7207554 << 7207555 >> 7207556

Preview

Coordinates	7207555.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	N'-2-butylidene-4-hydroxybenzohydrazide
Formula	C11 H14 N2 O2
Calculated formula	C11 H14 N2 O2
Title of publication	A series of compounds forming polar crystals and showing single-crystal-to-single-crystal transitions between polar phases
Authors of publication	Centore, Roberto; Jazbinsek, Mojca; Tuzi, Angela; Roviello, Antonio; Capobianco, Amedeo; Peluso, Andrea
Journal of publication	CrystEngComm
Year of publication	2012
Journal volume	14
Journal issue	8
Pages of publication	2645
a	9.916 ± 0.007 Å
b	9.185 ± 0.006 Å
c	11.738 ± 0.007 Å
α	90°
β	90°
γ	90°
Cell volume	1069.1 ± 1.2 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	4
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Residual factor for all reflections	0.1495
Residual factor for significantly intense reflections	0.0578
Weighted residual factors for significantly intense reflections	0.0986
Weighted residual factors for all reflections included in the refinement	0.1221
Goodness-of-fit parameter for all reflections included in the refinement	1.004
Diffraction radiation probe	x-ray
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
180406 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/75.	7207555.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7207555.cif
52035	2012-04-07	../uploads/cif-deposit/cod/cif Adding structures of 7207555, 7207556, 7207557, 7207558, 7207559, 7207560, 7207561, 7207562 via cif-deposit CGI script.	7207555.cif