Geometry & MOs

Info

ID:	20877
PubChem CID:	586258
Reduced:	FON3C12H12 (1)
Stoich.:	ABC3D12E12 (1)
Weight, g/mol:	233.09644
ΔH_f, kcal/mol:	-37.34
Dipole, Da:	3.07
IP(EA), eV:	-9.1(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-fluorophenyl)-3,5-dimethylpyrazole-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=NN1C(=O)NC2=CC=C(C=C2)F)C

DOS

IR

Vibrations