Geometry & MOs

Info

ID:	304596
PubChem CID:	124756433
Reduced:	ClFNO2C15H19 (1)
Stoich.:	ABCD2E15F19 (1)
Weight, g/mol:	281.118257
ΔH_f, kcal/mol:	-141.84
Dipole, Da:	4.02
IP(EA), eV:	-9.35(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-4-[(2-chloro-4-methylphenyl)methyl]-1-(2-methoxyethyl)pyrrolidin-2-one

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1F)C[C@H]2CC(=O)N(C2)CCOC)Cl

DOS

IR

Vibrations