Geometry & MOs

Info

ID:	333496
PubChem CID:	127252048
Reduced:	ON6C19H22 (1)
Stoich.:	AB6C19D22 (1)
Weight, g/mol:	377.152161
ΔH_f, kcal/mol:	66.12
Dipole, Da:	5.3
IP(EA), eV:	-8.85(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[2-[6-(1-methylpyrazol-4-yl)pyridin-3-yl]piperidin-1-yl]-2-oxoethyl]methanesulfonamide

Drug info:

PubChemData

Smile

CN1C=C(C=N1)C2=NC=C(C=C2)C3CCCCN3C(=O)C4=CN(N=C4)C

DOS

IR

Vibrations