Geometry & MOs

Info

ID:	68217
PubChem CID:	46507983
Reduced:	ON4C19H24 (1)
Stoich.:	AB4C19D24 (1)
Weight, g/mol:	324.102254
ΔH_f, kcal/mol:	2.85
Dipole, Da:	4.33
IP(EA), eV:	-9.26(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-benzoyl-5-(4-fluorophenyl)-1H-pyrazole-4-carbohydrazide

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)NNC(=O)C2=CC=C(C=C2)C3CCCCC3)C

DOS

IR

Vibrations