Geometry & MOs

Info

ID:	22011
PubChem CID:	594984
Reduced:	ClNO2H14C17 (1)
Stoich.:	ABC2D14E17 (1)
Weight, g/mol:	299.071306
ΔH_f, kcal/mol:	-37.34
Dipole, Da:	4.92
IP(EA), eV:	-8.92(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(4-chlorophenyl)-2-oxoethyl]-1-methyl-3H-indol-2-one

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2C(C1=O)CC(=O)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations