Geometry & MOs

Info

ID:	265734
PubChem CID:	103543258
Reduced:	NOC5H7 (3)
Stoich.:	ABC5D7 (3)
Weight, g/mol:	278.126657
ΔH_f, kcal/mol:	-92.6
Dipole, Da:	2.31
IP(EA), eV:	-8.36(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-amino-N-[(2-methyloxolan-2-yl)methyl]-1,3-benzodioxole-5-carboxamide

Drug info:

PubChemData

Smile

CN1CCCC1CN(C)C(=O)C2=CC3=C(C=C2N)OCO3

DOS

IR

Vibrations