Geometry & MOs

Info

ID:	352560
PubChem CID:	127283648
Reduced:	SN3O3C20H31 (1)
Stoich.:	AB3C3D20E31 (1)
Weight, g/mol:	399.252192
ΔH_f, kcal/mol:	-144.31
Dipole, Da:	6.38
IP(EA), eV:	-8.94(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[3-(morpholin-4-ylmethyl)benzoyl]piperidin-4-yl]-piperidin-1-ylmethanone

Drug info:

PubChemData

Smile

C1CCN(CC1)C(=O)C2CCN(CC2)C(=O)C3CSCN3C(=O)C4CCC4

DOS

IR

Vibrations