Geometry & MOs

Info

ID:	389898
PubChem CID:	134995827
Reduced:	ClO3C12H15 (1)
Stoich.:	AB3C12D15 (1)
Weight, g/mol:	183.162314
ΔH_f, kcal/mol:	-134.26
Dipole, Da:	4.76
IP(EA), eV:	-9.5(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-hexyl-2,2-dimethylazetidin-3-one

Drug info:

PubChemData

Smile

COC(=O)C[C@@H]([C@H](CC1=CC=CC=C1)Cl)O

DOS

IR

Vibrations