Geometry & MOs

Info

ID:	131002
PubChem CID:	51142008
Reduced:	SO3N4H16C19 (1)
Stoich.:	AB3C4D16E19 (1)
Weight, g/mol:	384.179755
ΔH_f, kcal/mol:	3.92
Dipole, Da:	7.6
IP(EA), eV:	-8.72(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3,4-dimethoxyphenyl)methyl]-2-[2-(2-hydroxyethylamino)benzimidazol-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CN2C(=NC(=CC2=O)CSC3=NN=C(O3)C4=CC=CC=C4OC)C=C1

DOS

IR

Vibrations