Geometry & MOs

Info

ID:	30542
PubChem CID:	841472
Reduced:	NSO3C17H17 (1)
Stoich.:	ABC3D17E17 (1)
Weight, g/mol:	300.129634
ΔH_f, kcal/mol:	-82.0
Dipole, Da:	2.56
IP(EA), eV:	-8.74(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C3CCC3

DOS

IR

Vibrations