Geometry & MOs

Info

ID:	127204
PubChem CID:	50994355
Reduced:	BrN2O2H11C14 (1)
Stoich.:	AB2C2D11E14 (1)
Weight, g/mol:	353.96738
ΔH_f, kcal/mol:	-20.12
Dipole, Da:	3.73
IP(EA), eV:	-9.4(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-bromo-5-(pyridine-3-carbonyl)phenyl]methanesulfonamide

Drug info:

PubChemData

Smile

CC(=O)NC1=CC(=CC(=C1)C(=O)C2=CN=CC=C2)Br

DOS

IR

Vibrations