Geometry & MOs

Info

ID:	73056
PubChem CID:	48416906
Reduced:	SO3N5H11C12 (1)
Stoich.:	AB3C5D11E12 (1)
Weight, g/mol:	333.122575
ΔH_f, kcal/mol:	-9.1
Dipole, Da:	5.75
IP(EA), eV:	-9.48(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(5-amino-4-cyanopyrazol-1-yl)-2-oxoethyl]-2-naphthalen-1-ylacetamide

Drug info:

PubChemData

Smile

CNS(=O)(=O)C1=CC=CC(=C1)C(=O)N2C(=C(C=N2)C#N)N

DOS

IR

Vibrations