Geometry & MOs

Info

ID:	265737
PubChem CID:	103543389
Reduced:	N2O4C13H18 (1)
Stoich.:	A2B4C13D18 (1)
Weight, g/mol:	264.147393
ΔH_f, kcal/mol:	-149.05
Dipole, Da:	1.23
IP(EA), eV:	-8.3(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations