Geometry & MOs

Info

ID:	148302
PubChem CID:	53787964
Reduced:	NSCl2O4C18H19 (1)
Stoich.:	ABC2D4E18F19 (1)
Weight, g/mol:	652.627065
ΔH_f, kcal/mol:	-138.87
Dipole, Da:	2.18
IP(EA), eV:	-8.57(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-dioctadecyl-4-phenyl-1,3-diazetidin-2-one

Drug info:

PubChemData

Smile

CCSOC(=O)CCC(C)OC1=C(C=C(C=C1)C2=C(C=C(C=N2)Cl)Cl)O

DOS

IR

Vibrations