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NHC-Charge.tgz Apr 13, 2021 - Publication data from the Simulation part for: "Charge Distribution in Cationic Molybdenum Imido Alkylidene N-Heterocyclic Carbene Complexes: A Combined X-Ray, XAS, XES, DFT, Moessbauer and Catalysis Approach" Gzip Archive - 28.1 MB - MD5: 20901409495178436f729f970e0ee16b Data Primary data from DFT calculations, compressed to a tar ball.
auxilliaries.tgz Apr 13, 2021 - Publication data of the Simulations for: "Reaction Mechanism of Ring-Closing Metathesis with a Cationic Molybdenum Imido Alkylidene N-Heterocyclic Carbene Catalyst" Gzip Archive - 4.5 MB - MD5: bbc2a5326211600b60a683375fd0c5d7 Data Primary data of the calculations for side aspects of the paper.
Initiation_Rx.tgz Apr 13, 2021 - Publication data of the Simulations for: "Reaction Mechanism of Ring-Closing Metathesis with a Cationic Molybdenum Imido Alkylidene N-Heterocyclic Carbene Catalyst" Gzip Archive - 442.3 MB - MD5: 009f5d81d96448b181cb33d77762eb2a Data Primary data of the calculations for the initiation reaction. All files combined to one tar-gz archive.
reaction_cycle.tgz Apr 13, 2021 - Publication data of the Simulations for: "Reaction Mechanism of Ring-Closing Metathesis with a Cationic Molybdenum Imido Alkylidene N-Heterocyclic Carbene Catalyst" Gzip Archive - 195.5 MB - MD5: c69cd8129245fcd155bea12d6bb88cd2 Data Primary data of the calculations for the catalytic cycle and the non-productive cycle. All files combined to one tar-gz archive.
GCMS.zip Apr 9, 2021 - Publication data for: "Molybdenum and Tungsten Alkylidyne Complexes Containing Mono-, Bi-, and Tridentate N-Heterocyclic Carbenes" - data from Buchmeiser group ZIP Archive - 54.4 MB - MD5: 36dacf787120c4b73f6543b22ed219ff
NMR experiments.zip Apr 9, 2021 - Publication data for: "Molybdenum and Tungsten Alkylidyne Complexes Containing Mono-, Bi-, and Tridentate N-Heterocyclic Carbenes" - data from Buchmeiser group ZIP Archive - 48.1 MB - MD5: 24c27c08e0832e70da4bfd8d850cf4a8
pure compounds.zip Apr 9, 2021 - Publication data for: "Molybdenum and Tungsten Alkylidyne Complexes Containing Mono-, Bi-, and Tridentate N-Heterocyclic Carbenes" - data from Buchmeiser group ZIP Archive - 54.2 MB - MD5: 4554e3c9f6035435c651db513d27c5f2
11b - RS-773.zip Apr 9, 2021 - Replication data for: Understanding Synthetic Peculiarities of Cationic Molybdenum(VI) Imido Alkylidene N‐Heterocyclic Carbene Complexes ZIP Archive - 4.6 MB - MD5: 932b870961b2adf1d466d73a3216e7d6
12 - RS-766.zip Apr 9, 2021 - Replication data for: Understanding Synthetic Peculiarities of Cationic Molybdenum(VI) Imido Alkylidene N‐Heterocyclic Carbene Complexes ZIP Archive - 2.9 MB - MD5: 95fc43fd0fea790facc9a6cbae859b95
14a - RS-708.zip Apr 9, 2021 - Replication data for: Understanding Synthetic Peculiarities of Cationic Molybdenum(VI) Imido Alkylidene N‐Heterocyclic Carbene Complexes ZIP Archive - 2.6 MB - MD5: 0ba0eb6bf8671582cdac7779ba41f3ba

NHC-Charge.tgz

Apr 13, 2021 - Publication data from the Simulation part for: "Charge Distribution in Cationic Molybdenum Imido Alkylidene N-Heterocyclic Carbene Complexes: A Combined X-Ray, XAS, XES, DFT, Moessbauer and Catalysis Approach"

Gzip Archive - 28.1 MB -

Data

Primary data from DFT calculations, compressed to a tar ball.

auxilliaries.tgz

Apr 13, 2021 - Publication data of the Simulations for: "Reaction Mechanism of Ring-Closing Metathesis with a Cationic Molybdenum Imido Alkylidene N-Heterocyclic Carbene Catalyst"

Gzip Archive - 4.5 MB -

Data

Primary data of the calculations for side aspects of the paper.

Initiation_Rx.tgz

Apr 13, 2021 - Publication data of the Simulations for: "Reaction Mechanism of Ring-Closing Metathesis with a Cationic Molybdenum Imido Alkylidene N-Heterocyclic Carbene Catalyst"