Geometry & MOs

Info

ID:	306391
PubChem CID:	125011547
Reduced:	O2N4C17H24 (1)
Stoich.:	A2B4C17D24 (1)
Weight, g/mol:	297.15896
ΔH_f, kcal/mol:	-38.46
Dipole, Da:	3.06
IP(EA), eV:	-8.27(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3S)-3-[2-(methylamino)pyridin-4-yl]piperidin-1-yl]-pyrazin-2-ylmethanone

Drug info:

PubChemData

Smile

CN(C)C1=NC(=CN2C1=CC=C2)[C@H]3CCCN3C(=O)CCOC

DOS

IR

Vibrations