Geometry & MOs

Info

ID:	228051
PubChem CID:	87563286
Reduced:	O2C7H10 (1)
Stoich.:	A2B7C10 (1)
Weight, g/mol:	181.073893
ΔH_f, kcal/mol:	-32.15
Dipole, Da:	3.19
IP(EA), eV:	-9.13(0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3H-1,2-benzodioxol-5-ylamino)ethanol

Drug info:

PubChemData

Smile

C#CCO.C1COC=C1

DOS

IR

Vibrations