Geometry & MOs

Info

ID:	235245
PubChem CID:	92304273
Reduced:	N2O3C24H28 (1)
Stoich.:	A2B3C24D28 (1)
Weight, g/mol:	392.209993
ΔH_f, kcal/mol:	-66.79
Dipole, Da:	2.35
IP(EA), eV:	-8.09(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-(3,4-dimethoxyphenyl)-3-(1-methylindol-3-yl)-1-pyrrolidin-1-ylpropan-1-one

Drug info:

PubChemData

Smile

CN1C=C(C2=CC=CC=C21)[C@@H](CC(=O)N3CCCC3)C4=CC(=C(C=C4)OC)OC

DOS

IR

Vibrations