Geometry & MOs

Info

ID:	153318
PubChem CID:	56312500
Reduced:	FNO5C21H24 (1)
Stoich.:	ABC5D21E24 (1)
Weight, g/mol:	355.149619
ΔH_f, kcal/mol:	-210.24
Dipole, Da:	4.09
IP(EA), eV:	-8.79(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-fluorophenyl)-N-[2-(2-fluorophenyl)-2-methylpropyl]pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)C1=CC(=C(C=C1)OCC(=O)OC)OC)C2=CC=CC=C2F

DOS

IR

Vibrations