Geometry & MOs

Info

ID:	150230
PubChem CID:	53789917
Reduced:	N2O3H13C14 (1)
Stoich.:	A2B3C13D14 (1)
Weight, g/mol:	308.152478
ΔH_f, kcal/mol:	-37.15
Dipole, Da:	13.66
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.677875
Charge, e:	0

Chem-info

IUPAC name:

3-(dimethylaminomethylidene)-1-(3-ethoxyphenyl)indol-2-one

Drug info:

PubChemData

Smile

CC1=[N+](N2C=C(C(=O)C3=CC=CC(=C1)C32)C(=O)O)C

DOS

IR

Vibrations