Geometry & MOs

Info

ID:	73339
PubChem CID:	48417469
Reduced:	SO3N6C13H14 (1)
Stoich.:	AB3C6D13E14 (1)
Weight, g/mol:	320.069159
ΔH_f, kcal/mol:	6.53
Dipole, Da:	3.43
IP(EA), eV:	-9.57(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(5-amino-4-cyanopyrazol-1-yl)-2-oxoethyl]-N-methylpyridine-3-sulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)N2C(=C(C=N2)C#N)N

DOS

IR

Vibrations