Geometry & MOs

Info

ID:	81407
PubChem CID:	49854691
Reduced:	NOC9H9 (2)
Stoich.:	ABC9D9 (2)
Weight, g/mol:	342.173213
ΔH_f, kcal/mol:	-15.92
Dipole, Da:	4.16
IP(EA), eV:	-8.69(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-3-[[4-(N-methylanilino)phenyl]methyl]-1H-indol-2-one

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=C(C=C1)CC2(C=NC3=CC=CC=C32)OC

DOS

IR

Vibrations