Geometry & MOs

Info

ID:	271164
PubChem CID:	103645917
Reduced:	ClON3H10C15 (1)
Stoich.:	ABC3D10E15 (1)
Weight, g/mol:	290.04582
ΔH_f, kcal/mol:	39.83
Dipole, Da:	9.85
IP(EA), eV:	-8.91(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-chloropyridin-3-yl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Drug info:

PubChemData

Smile

C1=CC2=C(C(=C1)C(=O)NC3=CN=C(C=C3)Cl)N=CC=C2

DOS

IR

Vibrations