Geometry & MOs

Info

ID:	447742
PubChem CID:	135285246
Reduced:	OC5H11 (2)
Stoich.:	AB5C11 (2)
Weight, g/mol:	160.14633
ΔH_f, kcal/mol:	-139.78
Dipole, Da:	2.82
IP(EA), eV:	-10.05(2.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-4-methylhexane-2,4-diol

Drug info:

PubChemData

Smile

CCC(C(C)O)C(CC)(CC)O

DOS

IR

Vibrations