Geometry & MOs

Info

ID:	54467
PubChem CID:	17388722
Reduced:	Br2N2S2O3H14C15 (1)
Stoich.:	A2B2C2D3E14F15 (1)
Weight, g/mol:	321.125946
ΔH_f, kcal/mol:	-24.55
Dipole, Da:	8.85
IP(EA), eV:	-8.78(-1.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,5-dihydro-1,3-thiazol-2-amine;(E)-3-[3-(dimethylaminodiazenyl)phenyl]prop-2-enoic acid

Drug info:

PubChemData

Smile

CS(=NS(=O)(=O)C1=CC=C(C=C1)N/C=C\2/C=C(C=C(C2=O)Br)Br)C

DOS

IR

Vibrations