Geometry & MOs

Info

ID:	123482
PubChem CID:	50849702
Reduced:	ON2H8C11 (2)
Stoich.:	AB2C8D11 (2)
Weight, g/mol:	269.062283
ΔH_f, kcal/mol:	67.31
Dipole, Da:	11.3
IP(EA), eV:	-8.78(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-phenyl-1,3-benzothiazole-6-carbohydrazide

Drug info:

PubChemData

Smile

CC1=CC(=C/C(=C\2/NC3=C(O2)C=CC(=C3)C4=CC=CC=C4)/C1=O)N5C=NN=C5

DOS

IR

Vibrations