Geometry & MOs

Info

ID:	51005
PubChem CID:	12013615
Reduced:	NOC6H7 (2)
Stoich.:	ABC6D7 (2)
Weight, g/mol:	543.236936
ΔH_f, kcal/mol:	22.16
Dipole, Da:	4.21
IP(EA), eV:	-9.08(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,4-dimethoxyphenyl)-N-[(2,4-dimethoxyphenyl)methyl]-3-prop-2-enoxy-N-prop-2-enylbenzimidazole-5-carboxamide

Drug info:

PubChemData

Smile

COCCON1C2=CC=CC=C2N=C1C=C

DOS

IR

Vibrations