Geometry & MOs

Info

ID:	235644
PubChem CID:	92710298
Reduced:	ClN2O4H21C24 (1)
Stoich.:	AB2C4D21E24 (1)
Weight, g/mol:	430.189257
ΔH_f, kcal/mol:	-90.14
Dipole, Da:	4.09
IP(EA), eV:	-8.44(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-1-benzoyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-2,3-dihydroindole-2-carboxamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1NC(=O)[C@@H]2CC3=CC=CC=C3N2C(=O)C4=CC=CC=C4)Cl)OC

DOS

IR

Vibrations