Geometry & MOs

Info

ID:	8579
PubChem CID:	79256
Reduced:	N2H4C5 (2)
Stoich.:	A2B4C5 (2)
Weight, g/mol:	184.074896
ΔH_f, kcal/mol:	103.81
Dipole, Da:	6.22
IP(EA), eV:	-9.39(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-1-phenylpyrazole-4-carbonitrile

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations