Geometry & MOs

Info

ID:	130604
PubChem CID:	51091604
Reduced:	NO2H7C9 (2)
Stoich.:	AB2C7D9 (2)
Weight, g/mol:	336.147393
ΔH_f, kcal/mol:	-93.46
Dipole, Da:	8.14
IP(EA), eV:	-8.89(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,7-dimethyl-N-[[3-(methylcarbamoyl)phenyl]methyl]-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C2C(=CC=C1)C(=C(O2)C(=O)NC3=CC4=C(C=C3)OC(=O)N4)C

DOS

IR

Vibrations