Geometry & MOs

Info

ID:	1829
PubChem CID:	5145
Reduced:	O7C13H18 (1)
Stoich.:	A7B13C18 (1)
Weight, g/mol:	286.105253
ΔH_f, kcal/mol:	-288.64
Dipole, Da:	4.2
IP(EA), eV:	-9.48(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(hydroxymethyl)-6-[2-(hydroxymethyl)phenoxy]oxane-3,4,5-triol

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)CO)OC2C(C(C(C(O2)CO)O)O)O

DOS

IR

Vibrations