Geometry & MOs

Info

ID:	157235
PubChem CID:	56422432
Reduced:	FN2O3C19H19 (1)
Stoich.:	AB2C3D19E19 (1)
Weight, g/mol:	424.207468
ΔH_f, kcal/mol:	-110.47
Dipole, Da:	6.17
IP(EA), eV:	-8.87(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(4-fluorophenyl)-3,5-dimethylpyrazol-4-yl]-N-(5-fluoro-2-piperidin-1-ylphenyl)acetamide

Drug info:

PubChemData

Smile

C1CCN(CC1)C2=C(C=C(C=C2)F)NC(=O)C3=C4C(=CC=C3)OCO4

DOS

IR

Vibrations