Geometry & MOs

Info

ID:	265736
PubChem CID:	103543300
Reduced:	BrClN2O3H10C14 (1)
Stoich.:	ABC2D3E10F14 (1)
Weight, g/mol:	266.126657
ΔH_f, kcal/mol:	-73.03
Dipole, Da:	3.8
IP(EA), eV:	-8.63(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-amino-N-(2-methoxy-2-methylpropyl)-1,3-benzodioxole-5-carboxamide

Drug info:

PubChemData

Smile

C1OC2=C(O1)C=C(C(=C2)C(=O)NC3=C(C=CC(=C3)Cl)Br)N

DOS

IR

Vibrations