Geometry & MOs

Info

ID:	363408
PubChem CID:	127310946
Reduced:	SO2N3C21H27 (1)
Stoich.:	AB2C3D21E27 (1)
Weight, g/mol:	395.260649
ΔH_f, kcal/mol:	-66.0
Dipole, Da:	3.78
IP(EA), eV:	-8.59(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-oxo-1-[(1-thiomorpholin-4-ylcyclohexyl)methylamino]propan-2-yl]cyclohexanecarboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)(CNC(=O)C2=CC3=CC=CC=C3C(=O)N2)N4CCSCC4

DOS

IR

Vibrations