Geometry & MOs

Info

ID:	235357
PubChem CID:	92309600
Reduced:	ClN2O2C22H25 (1)
Stoich.:	AB2C2D22E25 (1)
Weight, g/mol:	384.160456
ΔH_f, kcal/mol:	-36.52
Dipole, Da:	4.23
IP(EA), eV:	-8.93(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R,4S)-3-(4-chlorophenoxy)-4-[(cyclopentylamino)methyl]-1-(2-methylphenyl)azetidin-2-one

Drug info:

PubChemData

Smile

CC1=CC=CC=C1N2[C@@H]([C@H](C2=O)OC3=CC=C(C=C3)Cl)CNC4CCCC4

DOS

IR

Vibrations