Geometry & MOs

Info

ID:	61180
PubChem CID:	26706789
Reduced:	SN3O4C21H23 (1)
Stoich.:	AB3C4D21E23 (1)
Weight, g/mol:	377.119798
ΔH_f, kcal/mol:	-116.71
Dipole, Da:	3.65
IP(EA), eV:	-8.73(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methylphenyl)-N-[2-(prop-2-enylcarbamoyl)phenyl]-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

C[C@@H]1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=O)NC3=CC=CC=C3C(=O)NCC=C

DOS

IR

Vibrations