Geometry & MOs

Info

ID:	172928
PubChem CID:	75573843
Reduced:	NO4H13C17 (1)
Stoich.:	AB4C13D17 (1)
Weight, g/mol:	292.121178
ΔH_f, kcal/mol:	-39.96
Dipole, Da:	5.97
IP(EA), eV:	-9.2(-1.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-dimethyl-5-(3-oxo-3-phenylprop-1-enyl)benzimidazol-2-one

Drug info:

PubChemData

Smile

CC1=NOC(=O)C1=CC2=CC=C(O2)C3=CC=C(C=C3)C(=O)C

DOS

IR

Vibrations