(SP-5-12)-Chloro[1,8,15,22-tetrakis(phenylthio)-29H,31H-phthalocyaninato(2-)-κN29,κN30,κN31,κN32]aluminum

CAS Registry Number®

167093-23-4
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CAS Name

(SP-5-12)-Chloro[1,8,15,22-tetrakis(phenylthio)-29H,31H-phthalocyaninato(2-)-κN29,κN30,κN31,κN32]aluminum

Molecular Formula

C56H32AlClN8S4

Cite this Page

(SP-5-12)-Chloro[1,8,15,22-tetrakis(phenylthio)-29H,31H-phthalocyaninato(2-)-κN29,κN30,κN31,κN32]aluminum.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=167093-23-4 (retrieved 2024-04-30) (CAS RN: 167093-23-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C56H32N8S4.Al.ClH/c1-5-17-33(18-6-1)65-41-29-13-25-37-45(41)53-57-49(37)62-54-47-39(27-15-31-43(47)67-35-21-9-3-10-22-35)51(59-54)64-56-48-40(28-16-32-44(48)68-36-23-11-4-12-24-36)52(60-56)63-55-46-38(50(58-55)61-53)26-14-30-42(46)66-34-19-7-2-8-20-34;;/h1-32H;;1H/q-2;+3;/p-1

InChIKey

InChIKey=WZNPSCVVOXFVGQ-UHFFFAOYSA-M

SMILES

[Cl-][Al+3]123[N-]4C=5C=6C(C4=NC7=[N]1C(=NC=8[N-]2C(=C9C8C(SC%10=CC=CC=C%10)=CC=C9)N=C%11[N]3=C(N5)C=%12C%11=C(SC%13=CC=CC=C%13)C=CC%12)C=%14C7=C(SC%15=CC=CC=C%15)C=CC%14)=CC=CC6SC%16=CC=CC=C%16

Canonical SMILES

[Cl-][Al+3]123[N]4=C5N=C6C=7C(SC=8C=CC=CC8)=CC=CC7C(=NC=9C%10=C(SC=%11C=CC=CC%11)C=CC=C%10C(=NC%12=C%13C(SC=%14C=CC=CC%14)=CC=CC%13=C(N=C4C=%15C(SC=%16C=CC=CC%16)=CC=CC5%15)[N-]%121)[N]92)[N-]63

Other Names for this Substance

  • Aluminum, chloro[1,8,15,22-tetrakis(phenylthio)-29H,31H-phthalocyaninato(2-)-κN29,κN30,κN31,κN32]-, (SP-5-12)-
  • Aluminum, chloro[1,8,15,22-tetrakis(phenylthio)-29H,31H-phthalocyaninato(2-)-N29,N30,N31,N32]-, (SP-5-12)-
  • (SP-5-12)-Chloro[1,8,15,22-tetrakis(phenylthio)-29H,31H-phthalocyaninato(2-)-κN29,κN30,κN31,κN32]aluminum

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