Geometry & MOs

Info

ID:	351946
PubChem CID:	127282864
Reduced:	SO3N4C16H32 (1)
Stoich.:	AB3C4D16E32 (1)
Weight, g/mol:	311.166748
ΔH_f, kcal/mol:	-156.3
Dipole, Da:	6.67
IP(EA), eV:	-8.71(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-2-methylthiomorpholine-4-carboxamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)N1CCC(CC1)NC(=O)N(C)CC2CCN(CC2)C

DOS

IR

Vibrations