Geometry & MOs

Info

ID:	173033
PubChem CID:	75586396
Reduced:	O6N7C27H37 (1)
Stoich.:	A6B7C27D37 (1)
Weight, g/mol:	276.982797
ΔH_f, kcal/mol:	-225.39
Dipole, Da:	3.33
IP(EA), eV:	-8.5(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-1-(2-chloroethyl)-4-(4-chlorophenyl)azetidin-2-one

Drug info:

PubChemData

Smile

C1C(C(=O)NC(C(=O)NC(CC2=C(C=CC(=C2)C3=CC1=C(C=C3)O)O)C(=O)NCC(=O)NCCN)CCCN)N

DOS

IR

Vibrations