Geometry & MOs

Info

ID:	28502
PubChem CID:	827984
Reduced:	N3O3C19H19 (1)
Stoich.:	A3B3C19D19 (1)
Weight, g/mol:	243.137162
ΔH_f, kcal/mol:	-73.34
Dipole, Da:	9.13
IP(EA), eV:	-7.59(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-methyl-3-prop-2-enylbenzimidazol-2-ylidene)propanamide

Drug info:

PubChemData

Smile

CCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=CC=C(C=C3)N

DOS

IR

Vibrations