Geometry & MOs

Info

ID:	55350
PubChem CID:	17395272
Reduced:	S2O3N4C24H28 (1)
Stoich.:	A2B3C4D24E28 (1)
Weight, g/mol:	277.124883
ΔH_f, kcal/mol:	-55.71
Dipole, Da:	4.3
IP(EA), eV:	-8.71(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-2-(1-ethylbenzimidazol-2-yl)sulfanylpropanamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)NC(=O)C(C2=CC=CC=C2)SC3=NN=C(N3C)CC4CCS(=O)(=O)C4

DOS

IR

Vibrations