[2-(Allylamino)-4-Amino-1,3-Thiazol-5-Yl](5-Chloro-2-Thienyl)Methanone

Molecule SVG Image

Properties Simple | Detailed

Formula C11H10ClN3OS2
IUPAC Name [2-(allylamino)-4-amino-thiazol-5-yl]-(5-chloro-2-thienyl)methanone
Molecular Mass 299.800 g·mol−1
Heat of Formation 129.7 ± 16.7 kJ·mol−1
Dipole Moment 5.93 ± 1.08 D
Volume 322.15 Å 3
Surface Area 298.97 Å 2
HOMO Energy -8.43 ± 0.55 eV
LUMO Energy -1.04 ± eV
Point Group Symmetry C1
Synonyms
  • (2-allylamino-4-amino-thiazol-5-yl)-(5-chloro-thiophen-2-yl)-methanone
  • [2-(allylamino)-4-amino-5-thiazolyl]-(5-chloro-2-thienyl)methanone
  • [4-amino-2-(prop-2-enylamino)-1,3-thiazol-5-yl]-(5-chlorothiophen-2-yl)methanone
  • bas 07417279
InChIKey KOFQZAVTXLVRJI-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C Cl H O N S