Geometry & MOs

Info

ID:	338083
PubChem CID:	127258714
Reduced:	ClNO4C12H20 (1)
Stoich.:	ABC4D12E20 (1)
Weight, g/mol:	194.070972
ΔH_f, kcal/mol:	-166.23
Dipole, Da:	3.07
IP(EA), eV:	-10.08(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-hydroxybutan-2-yl 4-chlorobutanoate

Drug info:

PubChemData

Smile

CCCC(=O)CCO/N=C\COC(=O)CCCCl

DOS

IR

Vibrations