Geometry & MOs

Info

ID:	19807
PubChem CID:	573215
Reduced:	ClO2C10H17 (1)
Stoich.:	AB2C10D17 (1)
Weight, g/mol:	204.091708
ΔH_f, kcal/mol:	-130.91
Dipole, Da:	2.4
IP(EA), eV:	-10.6(0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-(chloromethyl)-1-methylcyclohexane-1-carboxylate

Drug info:

PubChemData

Smile

CC1(CCC(CC1)CCl)C(=O)OC

DOS

IR

Vibrations