Crystal structure of N‐[(1 Z )‐1‐(3‐methyl‐3‐phenylcyclobutyl)‐2‐thiomorpholin‐4‐ylethylidene] thiourea | Zendy

Sarı U. | Zendy; Yılmaz İ. | Zendy; Çukurovalı A. | Zendy; Güven K. | Zendy; Aksoy İ. | Zendy

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Crystal structure of N‐[(1 Z )‐1‐(3‐methyl‐3‐phenylcyclobutyl)‐2‐thiomorpholin‐4‐ylethylidene] thiourea

Author(s) -

Sarı U.,

Yılmaz İ.,

Çukurovalı A.,

Güven K.,

Aksoy İ.

Publication year - 2005

Publication title -

crystal research and technology

Language(s) - English

Resource type - Journals

SCImago Journal Rank - 0.377

H-Index - 64

eISSN - 1521-4079

pISSN - 0232-1300

DOI - 10.1002/crat.200410416

Subject(s) - orthorhombic crystal system , hydrogen bond , crystallography , chemistry , crystal structure , thiourea , moiety , intermolecular force , crystal (programming language) , molecule , bond length , stereochemistry , organic chemistry , computer science , programming language

The crystal structure of N‐[(1 Z )‐1‐(3‐methyl‐3‐phenylcyclobutyl)‐2‐thiomorpholin‐4‐ylethylidene] thiourea (C 18 H 26 N 4 S 2 ) has been determined by X‐ray crystallographic techniques. The compound crystallizes in the orthorhombic space group Pbca, with unit cell parameters: a = 15.692(3), b = 20.803(8), c = 11.979(6)Å, Z = 8, V = 3911(7)Å 3 . The crystal structure was solved by direct methods and refined by full‐matrix least squares to a final R‐value of 0.084 for 1447 observed reflections [ I > 2σ ( I ) ]. In the thiosemicarbazide moiety, the S = C bond length is 1.656(6), N‐C‐N angle is 115.6(5)°. The crystal structure is stabilized by the intermolecular N‐H...S hydrogen bonds. (© 2005 WILEY‐VCH Verlag GmbH & Co. KGaA, Weinheim)

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