Geometry & MOs

Info

ID:	349059
PubChem CID:	127274785
Reduced:	OSN2C9H14 (2)
Stoich.:	ABC2D9E14 (2)
Weight, g/mol:	371.177982
ΔH_f, kcal/mol:	-65.71
Dipole, Da:	6.03
IP(EA), eV:	-8.94(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-piperidin-1-ylpiperidin-1-yl)-2-(2-pyrazin-2-yl-1,3-thiazol-4-yl)ethanone

Drug info:

PubChemData

Smile

CCCC(=O)N1CSCC1C(=O)N2CCN(CC2)CC3=CSC(=N3)CC

DOS

IR

Vibrations