Geometry & MOs

Info

ID:	327696
PubChem CID:	126690764
Reduced:	BrN3C7H10 (1)
Stoich.:	AB3C7D10 (1)
Weight, g/mol:	405.183461
ΔH_f, kcal/mol:	49.25
Dipole, Da:	3.82
IP(EA), eV:	-8.29(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[5-(butylsulfamoyl)-6-(dimethylamino)-4-methylpyridin-3-yl]pyridin-2-yl]acetamide

Drug info:

PubChemData

Smile

C1C=CC2=C(N1)N(CC2Br)N

DOS

IR

Vibrations