Geometry & MOs

Info

ID:	11617
PubChem CID:	118217
Reduced:	ClO2C4H6 (2)
Stoich.:	AB2C4D6 (2)
Weight, g/mol:	242.011264
ΔH_f, kcal/mol:	-216.31
Dipole, Da:	0.19
IP(EA), eV:	-10.8(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-acetyloxy-1,4-dichlorobutan-2-yl) acetate

Drug info:

PubChemData

Smile

CC(=O)OC(CCl)C(CCl)OC(=O)C

DOS

IR

Vibrations