Geometry & MOs

Info

ID:	338082
PubChem CID:	127258713
Reduced:	ClNO2C11H16 (1)
Stoich.:	ABC2D11E16 (1)
Weight, g/mol:	277.108086
ΔH_f, kcal/mol:	-116.84
Dipole, Da:	2.8
IP(EA), eV:	-8.5(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2Z)-2-(3-oxohexoxyimino)ethyl] 4-chlorobutanoate

Drug info:

PubChemData

Smile

CCCC(=O)OCC1=CC=C(C=C1)N.Cl

DOS

IR

Vibrations