Geometry & MOs

Info

ID:	7863
PubChem CID:	74361
Reduced:	O3C10H20 (1)
Stoich.:	A3B10C20 (1)
Weight, g/mol:	188.141244
ΔH_f, kcal/mol:	-165.92
Dipole, Da:	3.18
IP(EA), eV:	-10.04(1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hexyl-1,3-dioxan-5-ol

Drug info:

PubChemData

Smile

CCCCCCC1OCC(CO1)O

DOS

IR

Vibrations