Geometry & MOs

Info

ID:	346178
PubChem CID:	127270669
Reduced:	SN3O3C20H33 (1)
Stoich.:	AB3C3D20E33 (1)
Weight, g/mol:	357.154469
ΔH_f, kcal/mol:	-138.8
Dipole, Da:	2.17
IP(EA), eV:	-8.87(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(thiomorpholine-4-carbonyl)cyclohexyl]thiomorpholine-4-carboxamide

Drug info:

PubChemData

Smile

C1CC(CCC1C(=O)N2CCSCC2)NC(=O)N(CC3CCOC3)C4CC4

DOS

IR

Vibrations