What is the molecular weight of Tris(norbornadiene)(acetylacetonato)iridium(III)?

The molecular weight is 567.7 g/mol.

What is the IUPAC name of Tris(norbornadiene)(acetylacetonato)iridium(III)?

The IUPAC name is bicyclo[2.2.1]hepta-2,5-diene;iridium;(Z)-4-oxopent-2-en-2-olate.

What is the Canonical SMILES of Tris(norbornadiene)(acetylacetonato)iridium(III)?

The Canonical SMILES is CC(=CC(=O)C)[O-].C1C2C=CC1C=C2.C1C2C=CC1C=C2.C1C2C=CC1C=C2.[Ir].

How many hydrogen bond donor counts are there in Tris(norbornadiene)(acetylacetonato)iridium(III)?

There are 0 hydrogen bond donor counts.

What is the molecular formula of Tris(norbornadiene)(acetylacetonato)iridium(III)?

The molecular formula is C26H31IrO2.

What is the topological polar surface area of Tris(norbornadiene)(acetylacetonato)iridium(III)?

The topological polar surface area is 40.1?2.

Is Tris(norbornadiene)(acetylacetonato)iridium(III) canonicalized?

Yes, the compound is canonicalized.

How many defined bond stereocenters are there in Tris(norbornadiene)(acetylacetonato)iridium(III)?

There is 1 defined bond stereocenter.

When was Tris(norbornadiene)(acetylacetonato)iridium(III) created and last modified?

It was created on May 22, 2019, and last modified on December 30, 2023.

Products

Tris(norbornadiene)(acetylacetonato)iridium(III)

Name: Tris(norbornadiene)(acetylacetonato)iridium(III)
SKU: ACM41612468
Rating: 5 (1 reviews)

Catalog Number

ACM41612468

CAS

41612-46-8

IUPAC Name

Bicyclo[2.2.1]hepta-2,5-diene;iridium;(Z)-4-oxopent-2-en-2-olate

Synonyms

Trisnorbornadieneacetylacetonatoiridium

Molecular Weight

567.7

Molecular Formula

C₂₆H₃₁IrO₂

Product Information

Canonical SMILES

CC(=CC(=O)C)[O-].C1C2C=CC1C=C2.C1C2C=CC1C=C2.C1C2C=CC1C=C2.[Ir]

InChI

InChI=1S/3C7H8.C5H8O2.Ir/c3*1-2-7-4-3-6(1)5-7;1-4(6)3-5(2)7;/h3*1-4,6-7H,5H2;3,6H,1-2H3;/p-1/b;4-3-;

InChI Key

ATNPDBQVYULDKK-YOLRLSNNSA-M

Melting Point

189 °C

Purity

Ir 99%

Appearance

Light yellow powder

Complexity

193

Covalently-Bonded Unit Count

Exact Mass

568.19533

Heavy Atom Count

MDL Number

MFCD28167048

Monoisotopic Mass

568.19533

Topological Polar Surface Area

40.1 Å²

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