Geometry & MOs

Info

ID:	5464
PubChem CID:	13188
Reduced:	ClO2C7H13 (1)
Stoich.:	AB2C7D13 (1)
Weight, g/mol:	164.060407
ΔH_f, kcal/mol:	-126.27
Dipole, Da:	2.9
IP(EA), eV:	-10.75(0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-chloroheptanoic acid

Drug info:

PubChemData

Smile

C(CCCCl)CCC(=O)O

DOS

IR

Vibrations