Geometry & MOs

Info

ID:	163911
PubChem CID:	74380763
Reduced:	SO2N4H22C25 (1)
Stoich.:	AB2C4D22E25 (1)
Weight, g/mol:	430.156039
ΔH_f, kcal/mol:	32.76
Dipole, Da:	3.73
IP(EA), eV:	-8.61(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-benzylbenzimidazol-2-yl)-N-[(3-chloro-4-methylphenyl)methylideneamino]propanamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C=NNC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4)C

DOS

IR

Vibrations