Geometry & MOs

Info

ID:	267127
PubChem CID:	103580911
Reduced:	NO3C10H17 (1)
Stoich.:	AB3C10D17 (1)
Weight, g/mol:	291.147058
ΔH_f, kcal/mol:	-117.9
Dipole, Da:	2.75
IP(EA), eV:	-9.47(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,3-benzodioxol-5-yl)-2-[(2-cyclopropyloxolan-3-yl)amino]ethanol

Drug info:

PubChemData

Smile

COC(=O)CNC1CCOC1C2CC2

DOS

IR

Vibrations