Geometry & MOs

Info

ID:	403968
PubChem CID:	135063683
Reduced:	N4F6H12C17 (1)
Stoich.:	A4B6C12D17 (1)
Weight, g/mol:	310.146999
ΔH_f, kcal/mol:	-225.09
Dipole, Da:	2.61
IP(EA), eV:	-8.96(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-phenyl-5-(4-phenylphenyl)pyrazole

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)NC2=CC(=NN2)NC3=CC=CC(=C3)C(F)(F)F)C(F)(F)F

DOS

IR

Vibrations