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| Format: | Recurso digital |
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Zenodo
2026
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| Online Access: | https://doi.org/10.5281/zenodo.19066633 |
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| _version_ | 1866901432173592576 |
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| author | Rzepa, Henry |
| author_facet | Rzepa, Henry |
| contents | Gaussian 16 (C01) calculation |
| format | Recurso digital |
| id | zenodo_https___doi_org_10_5281_zenodo_19066633 |
| institution | Zenodo |
| language | |
| publishDate | 2026 |
| publisher | Zenodo |
| record_format | zenodo |
| spellingShingle | OBIKIU (NO)2FeS5 G = -3514.303951 DDG = -20.82 dihed 61.6 Total Interaction (E) : -105.520 Rzepa, Henry InChI=1S/Fe.2NO.H2S5/c;2*1-2;1-3-5-4-2/h;;;1-2H/q+2;;;/p-2 IQGOKGPJEKJDGW-UHFFFAOYSA-L Gaussian 16 (C01) calculation |
| title | OBIKIU (NO)2FeS5 G = -3514.303951 DDG = -20.82 dihed 61.6 Total Interaction (E) : -105.520 |
| topic | InChI=1S/Fe.2NO.H2S5/c;2*1-2;1-3-5-4-2/h;;;1-2H/q+2;;;/p-2 IQGOKGPJEKJDGW-UHFFFAOYSA-L |
| url | https://doi.org/10.5281/zenodo.19066633 |