Geometry & MOs

Info

ID:	216216
PubChem CID:	85085903
Reduced:	O2C15H30 (1)
Stoich.:	A2B15C30 (1)
Weight, g/mol:	242.22458
ΔH_f, kcal/mol:	-72.8
Dipole, Da:	2.86
IP(EA), eV:	-9.74(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(hydroxymethyl)-4-methylpentyl]-2,3-dimethylcyclohexan-1-ol

Drug info:

PubChemData

Smile

CCCCCCCCC(C=CCCCC)OO

DOS

IR

Vibrations