Geometry & MOs

Info

ID:	235613
PubChem CID:	92710167
Reduced:	ON2C21H22 (1)
Stoich.:	AB2C21D22 (1)
Weight, g/mol:	316.157563
ΔH_f, kcal/mol:	19.01
Dipole, Da:	2.8
IP(EA), eV:	-8.68(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-1-(2,3-dihydroindol-1-yl)-3-phenyl-3-pyrrol-1-ylpropan-1-one

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1NC(=O)C[C@H](C2=CC=CC=C2)N3C=CC=C3

DOS

IR

Vibrations