Geometry & MOs

Info

ID:	345884
PubChem CID:	127270184
Reduced:	OSN3C8H13 (2)
Stoich.:	ABC3D8E13 (2)
Weight, g/mol:	367.229348
ΔH_f, kcal/mol:	-37.92
Dipole, Da:	8.5
IP(EA), eV:	-8.68(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-propyl-N-[4-(thiomorpholine-4-carbonyl)cyclohexyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CN1C(=NN=N1)SCCC(=O)NC2CCC(CC2)C(=O)N3CCSCC3

DOS

IR

Vibrations