Geometry & MOs

Info

ID:	383908
PubChem CID:	134975949
Reduced:	NOC13H27 (1)
Stoich.:	ABC13D27 (1)
Weight, g/mol:	279.050965
ΔH_f, kcal/mol:	-71.1
Dipole, Da:	1.04
IP(EA), eV:	-8.65(2.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 2-[acetyl(chloro)carbamoyl]pentanedioate

Drug info:

PubChemData

Smile

CCCC1(CC1(NC(C)(C)C)OC)CC

DOS

IR

Vibrations