Geometry & MOs

Info

ID:	330415
PubChem CID:	127247402
Reduced:	ON4C16H20 (1)
Stoich.:	AB4C16D20 (1)
Weight, g/mol:	286.142976
ΔH_f, kcal/mol:	11.61
Dipole, Da:	5.51
IP(EA), eV:	-9.55(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methoxypyridin-3-yl)-[3-(1H-pyrazol-5-yl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)CCC2=CN=CC=C2)C3=CC=NN3

DOS

IR

Vibrations