Geometry & MOs

Info

ID:	48877
PubChem CID:	11528428
Reduced:	OC5H10 (2)
Stoich.:	AB5C10 (2)
Weight, g/mol:	172.14633
ΔH_f, kcal/mol:	-125.33
Dipole, Da:	3.76
IP(EA), eV:	-10.03(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,2R)-3-methyl-6-propan-2-ylcyclohexane-1,2-diol

Drug info:

PubChemData

Smile

CCCC[C@H](C(=O)CCCC)O

DOS

IR

Vibrations