Geometry & MOs

Info

ID:	333473
PubChem CID:	127252025
Reduced:	ON4C23H24 (1)
Stoich.:	AB4C23D24 (1)
Weight, g/mol:	352.226312
ΔH_f, kcal/mol:	37.21
Dipole, Da:	3.99
IP(EA), eV:	-9.05(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclohexyl-[2-[6-(1-methylpyrazol-4-yl)pyridin-3-yl]piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

C1CCN(C(C1)C2=CN=C(C=C2)C3=CC=C(C=C3)C(=O)N)CC4=CC=CC=N4

DOS

IR

Vibrations