Geometry & MOs

Info

ID:	235630
PubChem CID:	92710245
Reduced:	ClN2O4C19H19 (1)
Stoich.:	AB2C4D19E19 (1)
Weight, g/mol:	338.126657
ΔH_f, kcal/mol:	-127.83
Dipole, Da:	6.46
IP(EA), eV:	-8.38(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-1-acetyl-N-(1,3-benzodioxol-5-ylmethyl)-2,3-dihydroindole-2-carboxamide

Drug info:

PubChemData

Smile

CC(=O)N1[C@H](CC2=CC=CC=C21)C(=O)NC3=CC(=C(C=C3OC)OC)Cl

DOS

IR

Vibrations