meso-Tetraphenyl-tetrabenzoporphine palladium complex

Catalog Number

ACM119654647-1

CAS

119654-64-7

Structure

Synonyms

Tetraphenyl-tetrabenzoporphyrin-Pd(II)

IUPAC Name

Palladium(2+);2,11,20,29-tetraphenyl-37,39-diaza-38,40-diazanidanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1(37),2,4,6,8,10,12(39),13,15,17,19,21,23,25,27,29,31,33,35-nonadecaene

Molecular Weight

919.39

Molecular Formula

C60H36N4Pd

Canonical SMILES

C1=CC=C(C=C1)C2=C3C4=CC=CC=C4C(=C(C5=NC(=C(C6=C7C=CC=CC7=C([N-]6)C(=C8C9=CC=CC=C9C2=N8)C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C15)C1=CC=CC=C1)[N-]3.[Pd+2]

InChI

InChI=1S/C60H36N4.Pd/c1-5-21-37(22-6-1)49-53-41-29-13-15-31-43(41)55(61-53)50(38-23-7-2-8-24-38)57-45-33-17-19-35-47(45)59(63-57)52(40-27-11-4-12-28-40)60-48-36-20-18-34-46(48)58(64-60)51(39-25-9-3-10-26-39)56-44-32-16-14-30-42(44)54(49)62-56;/h1-36H;/q-2;+2

InChI Key

WOKKIHAKMSHWEZ-UHFFFAOYSA-N

Purity

97%+

Appearance

Deep blue powde

Storage

Stored at +4 °C

• Catalog Number: ACM119654647-1
• CAS: 119654-64-7
• Synonyms: Tetraphenyl-tetrabenzoporphyrin-Pd(II)
• IUPAC Name: Palladium(2+);2,11,20,29-tetraphenyl-37,39-diaza-38,40-diazanidanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1(37),2,4,6,8,10,12(39),13,15,17,19,21,23,25,27,29,31,33,35-nonadecaene
• Molecular Weight: 919.39
• Molecular Formula: C60H36N4Pd
• Canonical SMILES: C1=CC=C(C=C1)C2=C3C4=CC=CC=C4C(=C(C5=NC(=C(C6=C7C=CC=CC7=C([N-]6)C(=C8C9=CC=CC=C9C2=N8)C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C15)C1=CC=CC=C1)[N-]3.[Pd+2]
• InChI: InChI=1S/C60H36N4.Pd/c1-5-21-37(22-6-1)49-53-41-29-13-15-31-43(41)55(61-53)50(38-23-7-2-8-24-38)57-45-33-17-19-35-47(45)59(63-57)52(40-27-11-4-12-28-40)60-48-36-20-18-34-46(48)58(64-60)51(39-25-9-3-10-26-39)56-44-32-16-14-30-42(44)54(49)62-56;/h1-36H;/q-2;+2
• InChI Key: WOKKIHAKMSHWEZ-UHFFFAOYSA-N
• Purity: 97%+
• Appearance: Deep blue powde
• Storage: Stored at +4 °C