Crystallography Open Database

Information card for entry 7234190

Preview

Coordinates	7234190.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H26 N6
Calculated formula	C18 H26 N6
SMILES	N(n1c(ccc1)c1n(N(C)C)c(c2n(N(C)C)ccc2)cc1)(C)C
Title of publication	Synthesis, characterization, and physical properties of oligo(1-(N,N-dimethylamino)pyrrole)s and their doped forms, precursors of candidates for molecular flat-band ferromagnets
Authors of publication	Yoshinori Yamanoi; Kazuhiro Takahashi; Takeshi Hamada; Norikazu Ohshima; Masashi Kurashina; Yohei Hattori; Tetsuro Kusamoto; Ryota Sakamoto; Mariko Miyachi; Hiroshi Nishihara
Journal of publication	Journal of Materials Chemistry C
Year of publication	2015
Journal volume	3
Pages of publication	4316 - 4320
a	14.8107 ± 0.0013 Å
b	7.9825 ± 0.0005 Å
c	15.3064 ± 0.0011 Å
α	90°
β	91.463 ± 0.001°
γ	90°
Cell volume	1809 ± 0.2 Å³
Cell temperature	103 K
Ambient diffraction temperature	103 K
Number of distinct elements	3
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	0.0576
Residual factor for significantly intense reflections	0.047
Weighted residual factors for significantly intense reflections	0.1117
Weighted residual factors for all reflections included in the refinement	0.12
Goodness-of-fit parameter for all reflections included in the refinement	1.165
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
218872 (current)	2019-09-26	cif/ Adding structures of 7234189, 7234190, 7234191, 7234192, 7234193 via cif-deposit CGI script.	7234190.cif