Geometry & MOs

Info

ID:	265728
PubChem CID:	103543016
Reduced:	N2O5C13H16 (1)
Stoich.:	A2B5C13D16 (1)
Weight, g/mol:	278.163043
ΔH_f, kcal/mol:	-178.07
Dipole, Da:	3.24
IP(EA), eV:	-8.48(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-amino-N-(3-ethylpentan-2-yl)-1,3-benzodioxole-5-carboxamide

Drug info:

PubChemData

Smile

CCN(CC(=O)OC)C(=O)C1=CC2=C(C=C1N)OCO2

DOS

IR

Vibrations