Geometry & MOs

Info

ID:	153521
PubChem CID:	56312758
Reduced:	FNO4C23H24 (1)
Stoich.:	ABC4D23E24 (1)
Weight, g/mol:	366.18559
ΔH_f, kcal/mol:	-131.85
Dipole, Da:	6.56
IP(EA), eV:	-8.7(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(3,5-dimethylpyrazol-1-yl)-N-[2-(2-fluorophenyl)-2-methylpropyl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)C1=CC=C(O1)COC2=CC=CC=C2OC)C3=CC=CC=C3F

DOS

IR

Vibrations