Geometry & MOs

Info

ID:	404019
PubChem CID:	135064506
Reduced:	FN2O2H21C25 (1)
Stoich.:	AB2C2D21E25 (1)
Weight, g/mol:	360.162649
ΔH_f, kcal/mol:	-26.85
Dipole, Da:	2.27
IP(EA), eV:	-9.2(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-3-naphthalen-1-yl-1,4-diphenylpyrazole

Drug info:

PubChemData

Smile

CC1=C(C(=NN1CC2=CC=C(C=C2)F)C3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

DOS

IR

Vibrations