Geometry & MOs

Info

ID:	264197
PubChem CID:	103440109
Reduced:	ClO2C9H17 (1)
Stoich.:	AB2C9D17 (1)
Weight, g/mol:	213.055656
ΔH_f, kcal/mol:	-140.32
Dipole, Da:	3.47
IP(EA), eV:	-10.51(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-4-(6-methylpyridin-3-yl)butanoic acid

Drug info:

PubChemData

Smile

CCOC(=O)CCC(C(C)C)Cl

DOS

IR

Vibrations