Geometry & MOs

Info

ID:	350520
PubChem CID:	127277882
Reduced:	S2N3O3C18H29 (1)
Stoich.:	A2B3C3D18E29 (1)
Weight, g/mol:	383.224263
ΔH_f, kcal/mol:	-153.93
Dipole, Da:	3.96
IP(EA), eV:	-8.87(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[4-[(2,6-dimethylmorpholin-4-yl)methyl]piperidine-1-carbonyl]-1,3-thiazolidin-3-yl]propan-1-one

Drug info:

PubChemData

Smile

CCC(=O)N1CSCC1C(=O)NC2CCC(CC2)C(=O)N3CCSCC3

DOS

IR

Vibrations