Geometry & MOs

Info

ID:	18509
PubChem CID:	541984
Reduced:	N2O3C11H14 (1)
Stoich.:	A2B3C11D14 (1)
Weight, g/mol:	222.100442
ΔH_f, kcal/mol:	-43.67
Dipole, Da:	2.49
IP(EA), eV:	-8.71(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[6-[2-(methylamino)ethyl]-1,3-benzodioxol-5-yl]methylidene]hydroxylamine

Drug info:

PubChemData

Smile

CNCCC1=CC2=C(C=C1C=NO)OCO2

DOS

IR

Vibrations