Geometry & MOs

Info

ID:	361872
PubChem CID:	127304866
Reduced:	SN3O3C17H29 (1)
Stoich.:	AB3C3D17E29 (1)
Weight, g/mol:	387.172896
ΔH_f, kcal/mol:	-141.98
Dipole, Da:	4.36
IP(EA), eV:	-8.79(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(morpholin-4-ylmethyl)piperidin-1-yl]-2-(2-pyrazin-2-yl-1,3-thiazol-4-yl)ethanone

Drug info:

PubChemData

Smile

CCC(=O)N1CSCC1C(=O)N2CCCCC2CN3CCOCC3

DOS

IR

Vibrations