Geometry & MOs

Info

ID:	356314
PubChem CID:	127291387
Reduced:	SO2N4C20H26 (1)
Stoich.:	AB2C4D20E26 (1)
Weight, g/mol:	371.224263
ΔH_f, kcal/mol:	-47.04
Dipole, Da:	0.84
IP(EA), eV:	-8.79(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,3-dimethylbutanoyl)-N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)N1C2=C(C=CC(=C2)NC(=O)C3CSCN3C(=O)C4CCCC4)C=N1

DOS

IR

Vibrations