Geometry & MOs

Info

ID:	369272
PubChem CID:	127332026
Reduced:	FO3N4C19H23 (1)
Stoich.:	AB3C4D19E23 (1)
Weight, g/mol:	356.20124
ΔH_f, kcal/mol:	-86.51
Dipole, Da:	2.63
IP(EA), eV:	-8.93(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-fluoro-5-methylphenyl)-3-[4-(1H-pyrazol-5-yl)piperidin-1-yl]piperidin-2-one

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)F)N2CCCC(C2=O)N3CCOC(C3)C4=NOC(=N4)C

DOS

IR

Vibrations