Geometry & MOs

Info

ID:	343409
PubChem CID:	127266582
Reduced:	BrOSN3C13H18 (1)
Stoich.:	ABCD3E13F18 (1)
Weight, g/mol:	329.119798
ΔH_f, kcal/mol:	-9.05
Dipole, Da:	4.8
IP(EA), eV:	-8.69(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-acetyl-2-(6-phenyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetohydrazide

Drug info:

PubChemData

Smile

CCN1CCN(C(C1)C)C(=O)C2=CC(=CNC2=S)Br

DOS

IR

Vibrations