Geometry & MOs

Info

ID:	124787
PubChem CID:	50895989
Reduced:	ISO2N4H11C13 (1)
Stoich.:	ABC2D4E11F13 (1)
Weight, g/mol:	367.146681
ΔH_f, kcal/mol:	56.3
Dipole, Da:	3.97
IP(EA), eV:	-9.87(-1.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(2-hydrazinyl-1,3-benzothiazol-6-yl)piperazin-1-yl]-(4-methylphenyl)methanone

Drug info:

PubChemData

Smile

CC(C)OC(=O)C1=NN=C2N1N=C(S2)C3=CC(=CC=C3)I

DOS

IR

Vibrations