Geometry & MOs

Info

ID:	11297
PubChem CID:	113433
Reduced:	OC15H30 (1)
Stoich.:	AB15C30 (1)
Weight, g/mol:	226.229666
ΔH_f, kcal/mol:	-116.62
Dipole, Da:	1.95
IP(EA), eV:	-10.02(3.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-4-(3-propan-2-ylcyclohexyl)pentan-2-ol

Drug info:

PubChemData

Smile

CC(C)C1CCCC(C1)C(C)(C)CC(C)O

DOS

IR

Vibrations