Geometry & MOs

Info

ID:	347258
PubChem CID:	127271799
Reduced:	SO3N5C16H27 (1)
Stoich.:	AB3C5D16E27 (1)
Weight, g/mol:	399.110891
ΔH_f, kcal/mol:	-109.08
Dipole, Da:	9.58
IP(EA), eV:	-8.47(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-tert-butyl-1,3-thiazol-4-yl)-1-[4-(thiomorpholine-4-carbonyl)-1,3-thiazolidin-3-yl]ethanone

Drug info:

PubChemData

Smile

CC1=NC(=CN1C)S(=O)(=O)NCC(=O)N2CCCC2CN3CCCC3

DOS

IR

Vibrations