Geometry & MOs

Info

ID:	4513
PubChem CID:	11530
Reduced:	ClO2C6H11 (1)
Stoich.:	AB2C6D11 (1)
Weight, g/mol:	150.044757
ΔH_f, kcal/mol:	-115.52
Dipole, Da:	3.03
IP(EA), eV:	-10.89(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butyl 2-chloroacetate

Drug info:

PubChemData

Smile

CCCCOC(=O)CCl

DOS

IR

Vibrations