Geometry & MOs

Info

ID:	17924
PubChem CID:	527969
Reduced:	ClO2C13H25 (1)
Stoich.:	AB2C13D25 (1)
Weight, g/mol:	248.154308
ΔH_f, kcal/mol:	-160.88
Dipole, Da:	1.7
IP(EA), eV:	-10.66(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloroundecyl acetate

Drug info:

PubChemData

Smile

CCCCCCCCC(CCOC(=O)C)Cl

DOS

IR

Vibrations