Geometry & MOs

Info

ID:	73303
PubChem CID:	48417398
Reduced:	SO4N5C14H15 (1)
Stoich.:	AB4C5D14E15 (1)
Weight, g/mol:	378.111024
ΔH_f, kcal/mol:	-52.52
Dipole, Da:	7.89
IP(EA), eV:	-9.44(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(5-amino-4-cyanopyrazol-1-yl)-2-oxoethyl]-N,N-diethyl-6-oxopyridine-3-sulfonamide

Drug info:

PubChemData

Smile

CN(C)S(=O)(=O)C1=C(C=CC(=C1)C(=O)N2C(=C(C=N2)C#N)N)OC

DOS

IR

Vibrations