Geometry & MOs

Info

ID:	188329
PubChem CID:	77700620
Reduced:	SN2F3O6C21H35 (1)
Stoich.:	AB2C3D6E21F35 (1)
Weight, g/mol:	260.119464
ΔH_f, kcal/mol:	-441.04
Dipole, Da:	6.18
IP(EA), eV:	-9.55(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(dimethylamino)-5-propan-2-yl-5,6,7,7a-tetrahydro-3aH-pyrano[3,2-d][1,3]thiazole-6,7-diol

Drug info:

PubChemData

Smile

CCCCOC1C2C(OC(C1OCCCC)C(C(F)(F)F)O)SC(=N2)NC(=O)OC(C)(C)C

DOS

IR

Vibrations