Geometry & MOs

Info

ID:	170882
PubChem CID:	75292144
Reduced:	ClNO2H18C19 (1)
Stoich.:	ABC2D18E19 (1)
Weight, g/mol:	417.149557
ΔH_f, kcal/mol:	-35.32
Dipole, Da:	3.97
IP(EA), eV:	-9.21(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-7-chloro-3-hydroxy-3-(1-phenylpent-2-enyl)indol-2-one

Drug info:

PubChemData

Smile

CCC=CC(C1=CC=CC=C1)C2(C3=C(C(=CC=C3)Cl)NC2=O)O

DOS

IR

Vibrations