Geometry & MOs

Info

ID:	61908
PubChem CID:	26715579
Reduced:	FN2O3C20H23 (1)
Stoich.:	AB2C3D20E23 (1)
Weight, g/mol:	454.225643
ΔH_f, kcal/mol:	-164.87
Dipole, Da:	4.01
IP(EA), eV:	-8.78(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(4-methoxyphenyl)-1H-indol-3-yl]-1-[(2R)-2-(4-methoxyphenyl)pyrrolidin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)C2=CC=C(C=C2)CNC(=O)OC(C)(C)C)F

DOS

IR

Vibrations