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Cp.Benzene.ScS5 G = -3254.457474 DG = -5.56 NBO7 Def2-QZVPP

Name: Cp.Benzene.ScS5 G = -3254.457474 DG = -5.56 NBO7 Def2-QZVPP
Published: 2026-04-05
License: cc-zero
Keywords: InChI=1S/C13H13.S5.Sc/c1-2-6-12(7-3-1)10-11-13-8-4-5-9-13;1-3-5-4-2;/h1-9H,10-11H2;;, CNVHKJMCYLXECY-UHFFFAOYSA-N

InChI=1S/C13H13.S5.Sc/c1-2-6-12(7-3-1)10-11-13-8-4-5-9-13 1-3-5-4-2 /h1-9H 10-11H2 CNVHKJMCYLXECY-UHFFFAOYSA-N

Gaussian 16 (C01) calculation

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CreatorRzepa, Henry

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Published2026-04-05

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DOI10.5281/zenodo.19431361

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Downloads16

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Licensecc-zero

File Size241.0 MB

Data TypeDataset

Published2026

Licensecc-zero

Total Views26

Total Downloads16

Gaussian 16 (C01) calculation

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Cp.Benzene.ScS5 G = -3254.457474 DG = -5.56 NBO7… (Full Dataset)241.0 MB

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ReadmeVia DOI record

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Files are hosted on the source repository. Click download to access the full dataset.

Rzepa, Henry (2026). Cp.Benzene.ScS5 G = -3254.457474 DG = -5.56 NBO7 Def2-QZVPP. https://doi.org/10.5281/zenodo.19431361

Cp.Benzene.ScS5 G = -3254.457474 DG = -5.56 NBO7 Def2-QZVPP

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