Geometry & MOs

Info

ID:	64944
PubChem CID:	29204233
Reduced:	SO2N3C13H15 (1)
Stoich.:	AB2C3D13E15 (1)
Weight, g/mol:	413.00449
ΔH_f, kcal/mol:	-50.98
Dipole, Da:	1.36
IP(EA), eV:	-8.94(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-5-[methoxy(methyl)sulfamoyl]-N-(pyridin-3-ylmethyl)benzamide

Drug info:

PubChemData

Smile

CC1=CSC(=O)N1CCC(=O)NCC2=CN=CC=C2

DOS

IR

Vibrations