Geometry & MOs

Info

ID:	73322
PubChem CID:	48417420
Reduced:	SO3N4H12C13 (1)
Stoich.:	AB3C4D12E13 (1)
Weight, g/mol:	273.086189
ΔH_f, kcal/mol:	-24.14
Dipole, Da:	9.89
IP(EA), eV:	-9.29(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(5-amino-4-cyanopyrazol-1-yl)-1-oxopropan-2-yl]furan-2-carboxamide

Drug info:

PubChemData

Smile

CS(=O)(=O)CC1=CC=C(C=C1)C(=O)N2C(=C(C=N2)C#N)N

DOS

IR

Vibrations