Synonyms
102601-62-7;2-Chloro-4-benzamido-5-methylbenzenediazonium chloride hemi(zinc chloride) salt;DTXSID80662246;AKOS024419240;4-Benzamido-2-chloro-5-methylbenzene-1-diazonium chloride--dichlorozinc (2/2/1);
IUPAC Name
4-benzamido-2-chloro-5-methylbenzenediazonium;dichlorozinc;dichloride;
Molecular Weight
752.604g/mol
Molecular Formula
C28H22Cl6N6O2Zn;
Canonical SMILES
CC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)Cl)[N+]#N.CC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)Cl)[N+]#N.[Cl-].[Cl-].Cl[Zn]Cl;
InChI
InChI=1S/2C14H10ClN3O.4ClH.Zn/c2*1-9-7-13(18-16)11(15)8-12(9)17-14(19)10-5-3-2-4-6-10;;;;;/h2*2-8H,1H3;4*1H;/q;;;;;;+2/p-2;
InChI Key
IVOFXIDUIYHLQW-UHFFFAOYSA-L;
Complexity
375
Covalently-Bonded Unit Count
5
Exact Mass
749.92g/mol
H-Bond Acceptor
6
H-Bond Donor
2
Heavy Atom Count
43
Monoisotopic Mass
747.923g/mol
Rotatable Bond Count
4
Topological Polar Surface Area
115A^2
