Geometry & MOs

Info

ID:	159207
PubChem CID:	57264378
Reduced:	ON3C11H11 (1)
Stoich.:	AB3C11D11 (1)
Weight, g/mol:	166.084124
ΔH_f, kcal/mol:	70.72
Dipole, Da:	5.23
IP(EA), eV:	-9.28(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

hexane-1,2,2,3,3-pentol

Drug info:

PubChemData

Smile

CN1C=NC(=N1)C2C(O2)C3=CC=CC=C3

DOS

IR

Vibrations