Geometry & MOs

Info

ID:	73388
PubChem CID:	48417589
Reduced:	S2O3N5H15C18 (1)
Stoich.:	A2B3C5D15E18 (1)
Weight, g/mol:	387.045982
ΔH_f, kcal/mol:	16.75
Dipole, Da:	3.65
IP(EA), eV:	-9.04(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[2-(5-amino-4-cyanopyrazol-1-yl)-2-oxoethyl]phenyl]thiophene-2-sulfonamide

Drug info:

PubChemData

Smile

C1CN(CC2=C1SC=C2)S(=O)(=O)C3=CC=CC(=C3)C(=O)N4C(=C(C=N4)C#N)N

DOS

IR

Vibrations