Crystal structure and Hirshfeld analysis of di-tert-butyl 2, 2?-[(ethylazanediyl) bis (methylene)] bis (1H-pyrrole-1-carboxylate)
Yükleniyor...
Dosyalar
Tarih
2020
Dergi Başlığı
Dergi ISSN
Cilt Başlığı
Yayıncı
Erişim Hakkı
info:eu-repo/semantics/openAccess
Özet
The title compound, C22H33N3O4, crystallizes in the triclinic space group P\overline{1} with two molecules in a unit cell. The two pyrrole rings are essentially planar (r.m.s. deviation = 0.002?Å) and they form a dihedral angle of 81.24?(10)° with each other. The crystal packing is stabilized by C—H?? interactions and ?–? stacking interactions, forming a three-dimensional network. The Hirshfeld surface analysis and two-dimensional fingerprint plots reveal that the most important contributions for the crystal packing are from H?H (74.3%), C?H/H?C (11.5%) and O?H/H?O (9.1%) contacts.
Açıklama
TARAMAWOS
TARAMAPUBMED
TARAMASCOPUS
TARAMAPUBMED
TARAMASCOPUS
Anahtar Kelimeler
Crystal structure, Pyrrole ring, C—H...? interactions, ?–? stacking interactions, Hirshfeld surface analysis.
Kaynak
Acta Cryst
WoS Q Değeri
N/A
Scopus Q Değeri
N/A
Cilt
E76
