Geometry & MOs

Info

ID:	186149
PubChem CID:	77396308
Reduced:	NO2C12H13 (1)
Stoich.:	AB2C12D13 (1)
Weight, g/mol:	208.094688
ΔH_f, kcal/mol:	-53.11
Dipole, Da:	3.09
IP(EA), eV:	-9.18(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2-hydroxyethoxy)-2-(hydroxymethyl)oxane-3,4-diol

Drug info:

PubChemData

Smile

C1C=CC2=CC=CC=C2C1C(C(=O)O)N

DOS

IR

Vibrations