Geometry & MOs

Info

ID:	250757
PubChem CID:	103098887
Reduced:	BrN5H6C7 (1)
Stoich.:	AB5C6D7 (1)
Weight, g/mol:	317.95346
ΔH_f, kcal/mol:	91.15
Dipole, Da:	1.58
IP(EA), eV:	-9.26(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(3-amino-5-bromo-1,2,4-triazol-1-yl)pyridine-3-sulfonamide

Drug info:

PubChemData

Smile

C1=CN=CC=C1N2C(=NC(=N2)N)Br

DOS

IR

Vibrations