Geometry & MOs

Info

ID:	443571
PubChem CID:	135259363
Reduced:	N2O2C19H28 (1)
Stoich.:	A2B2C19D28 (1)
Weight, g/mol:	532.196075
ΔH_f, kcal/mol:	-70.55
Dipole, Da:	5.26
IP(EA), eV:	-9.26(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R)-3-amino-5-[(1R,2R,3S)-3-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-2-(4-fluorophenyl)cyclopentyl]-3-methylpyrrolidin-2-one

Drug info:

PubChemData

Smile

CCOC(=NC=O)N(C)CC1CCCC(C1)C2=CC=CC=C2C

DOS

IR

Vibrations