Geometry & MOs

Info

ID:	39720
PubChem CID:	8142037
Reduced:	FSN2O2C16H17 (1)
Stoich.:	ABC2D2E16F17 (1)
Weight, g/mol:	346.135114
ΔH_f, kcal/mol:	-78.45
Dipole, Da:	3.75
IP(EA), eV:	-8.94(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-ethoxyphenoxy)-N-[(6S)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]acetamide

Drug info:

PubChemData

Smile

C[C@@H]1CCC2=C(C1)SC(=N2)NC(=O)COC3=CC=CC=C3F

DOS

IR

Vibrations