Geometry & MOs

Info

ID:	356178
PubChem CID:	127291214
Reduced:	SO3N4C19H32 (1)
Stoich.:	AB3C4D19E32 (1)
Weight, g/mol:	397.239913
ΔH_f, kcal/mol:	-125.96
Dipole, Da:	5.66
IP(EA), eV:	-8.86(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(cyclopentanecarbonyl)-N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1CC1)N2CCN(CC2)C(=O)C3CSCN3C(=O)C(C)(C)C

DOS

IR

Vibrations