Crystallography Open Database

Information card for entry 2100764

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Coordinates	2100764.cif
Original IUCr paper	HTML

Structure parameters

Formula	C15 H19 N O2
Calculated formula	C15 H19 N O2
SMILES	N1([C@@H]2[C@@]3(O)c4ccccc4[C@H]3CC2)CCOCC1.N1([C@H]2[C@]3(O)c4ccccc4[C@@H]3CC2)CCOCC1
Title of publication	Synthesis and structure of new bronchospasmolytic agents. I
Authors of publication	Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Gregoire, B.; Mouaddib, A.; Caubère, P.
Journal of publication	Acta Crystallographica Section B
Year of publication	1992
Journal volume	48
Journal issue	2
Pages of publication	178 - 185
a	10.36 ± 0.005 Å
b	12.169 ± 0.005 Å
c	12.488 ± 0.004 Å
α	95.14 ± 0.1°
β	108.49 ± 0.12°
γ	114.69 ± 0.05°
Cell volume	1310.8 ± 1.9 Å³
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Diffraction radiation wavelength	1.54056 Å
Diffraction radiation type	Cu
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

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