Geometry & MOs

Info

ID:	256972
PubChem CID:	103142836
Reduced:	OCl2C11H20 (1)
Stoich.:	AB2C11D20 (1)
Weight, g/mol:	255.162314
ΔH_f, kcal/mol:	-109.02
Dipole, Da:	3.52
IP(EA), eV:	-9.86(0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-1-isoquinolin-8-ylcyclohexan-1-ol

Drug info:

PubChemData

Smile

CCC(CC1CCC(O1)C)(CCl)CCl

DOS

IR

Vibrations