Geometry & MOs

Info

ID:	327675
PubChem CID:	126690703
Reduced:	BrON2C11H13 (1)
Stoich.:	ABC2D11E13 (1)
Weight, g/mol:	348.125612
ΔH_f, kcal/mol:	-12.96
Dipole, Da:	2.11
IP(EA), eV:	-9.4(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC(=C)NC(=O)C1=C(N=CC(=C1)Br)C

DOS

IR

Vibrations