Geometry & MOs

Info

ID:	77683
PubChem CID:	49658636
Reduced:	OSN2C13H13 (2)
Stoich.:	ABC2D13E13 (2)
Weight, g/mol:	476.134068
ΔH_f, kcal/mol:	9.97
Dipole, Da:	3.74
IP(EA), eV:	-8.8(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-[2-(2,3-dimethylanilino)-2-oxoethyl]sulfanylimidazol-1-yl]-N-(thiophen-2-ylmethyl)benzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)NC(=O)CSC2=NC=CN2C3=CC=CC(=C3)C(=O)NCC4=CC=CS4)C

DOS

IR

Vibrations