Geometry & MOs

Info

ID:	27672
PubChem CID:	822941
Reduced:	NOC17H19 (1)
Stoich.:	ABC17D19 (1)
Weight, g/mol:	327.163457
ΔH_f, kcal/mol:	12.11
Dipole, Da:	1.93
IP(EA), eV:	-8.73(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-(3-fluoro-4-methoxyphenyl)-2-phenyl-3-pyrrolidin-1-ylpropan-1-one

Drug info:

PubChemData

Smile

CN(C)C[C@H](C1=CC=CC=C1)C(=O)C2=CC=CC=C2

DOS

IR

Vibrations