Geometry & MOs

Info

ID:	55194
PubChem CID:	17389876
Reduced:	NO4C11H17 (1)
Stoich.:	AB4C11D17 (1)
Weight, g/mol:	271.069202
ΔH_f, kcal/mol:	-138.0
Dipole, Da:	5.4
IP(EA), eV:	-8.89(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-2-(1,3-benzodioxol-5-yl)ethanol;oxalic acid

Drug info:

PubChemData

Smile

COC1=C(C(=C(C=C1)C(CO)N)OC)OC

DOS

IR

Vibrations