Geometry & MOs

Info

ID:	73251
PubChem CID:	48417282
Reduced:	SO2N4H10C16 (1)
Stoich.:	AB2C4D10E16 (1)
Weight, g/mol:	288.104482
ΔH_f, kcal/mol:	53.14
Dipole, Da:	5.5
IP(EA), eV:	-8.98(-1.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-1-(4-ethyl-5-propylthiophene-2-carbonyl)pyrazole-4-carbonitrile

Drug info:

PubChemData

Smile

C1C2=C(C3=CC=CC=C3O1)SC(=C2)C(=O)N4C(=C(C=N4)C#N)N

DOS

IR

Vibrations