Geometry & MOs

Info

ID:	338090
PubChem CID:	127258721
Reduced:	ClO3C10H17 (1)
Stoich.:	AB3C10D17 (1)
Weight, g/mol:	206.070972
ΔH_f, kcal/mol:	-172.03
Dipole, Da:	4.52
IP(EA), eV:	-10.26(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-oxopentyl 4-chlorobutanoate

Drug info:

PubChemData

Smile

CCCC(=O)CCOC(=O)CCCCl

DOS

IR

Vibrations