Geometry & MOs

Info

ID:	27126
PubChem CID:	814752
Reduced:	ON2C21H22 (1)
Stoich.:	AB2C21D22 (1)
Weight, g/mol:	338.145285
ΔH_f, kcal/mol:	28.89
Dipole, Da:	6.12
IP(EA), eV:	-8.29(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-(1-methylindol-3-yl)-1-pyrrolidin-1-yl-3-thiophen-2-ylpropan-1-one

Drug info:

PubChemData

Smile

CN1C=C(C2=CC=CC=C21)[C@H](CC(=O)NC3CC3)C4=CC=CC=C4

DOS

IR

Vibrations