Geometry & MOs

Info

ID:	39705
PubChem CID:	8141996
Reduced:	SF2N2O2C16H16 (1)
Stoich.:	AB2C2D2E16F16 (1)
Weight, g/mol:	376.145678
ΔH_f, kcal/mol:	-143.04
Dipole, Da:	3.86
IP(EA), eV:	-8.89(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C[C@@H]1CCC2=C(C1)SC(=N2)NC(=O)C3=CC(=CC=C3)OC(F)F

DOS

IR

Vibrations