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CYPTIS4 -2828.955733 + ⅛S8= -398.16539925) = -3,227.12113225, DG = -12.99 E2PERT = 5.0 ordered by energy

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Bibliographic Details
Main Author:	Rzepa, Henry
Format:	Recurso digital
Published:	Zenodo 2026
Subjects:	InChI=1S/2C5H5.S4.Ti/c21-2-4-5-3-1;1-3-4-2;/h21-5H;; ZPLIKENUWGCSRI-UHFFFAOYSA-N
Online Access:	Acceder al recurso
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_version_	1866902286601551872
author	Rzepa, Henry
author_facet	Rzepa, Henry
contents	Gaussian 16 (C01) calculation
format	Recurso digital
id	zenodo_https___doi_org_10_5281_zenodo_19144148
institution	Zenodo
language
publishDate	2026
publisher	Zenodo
record_format	zenodo
spellingShingle	CYPTIS4 -2828.955733 + ⅛S8= -398.16539925) = -3,227.12113225, DG = -12.99 E2PERT = 5.0 ordered by energy Rzepa, Henry InChI=1S/2C5H5.S4.Ti/c21-2-4-5-3-1;1-3-4-2;/h21-5H;; ZPLIKENUWGCSRI-UHFFFAOYSA-N Gaussian 16 (C01) calculation
title	CYPTIS4 -2828.955733 + ⅛S8= -398.16539925) = -3,227.12113225, DG = -12.99 E2PERT = 5.0 ordered by energy
topic	InChI=1S/2C5H5.S4.Ti/c21-2-4-5-3-1;1-3-4-2;/h21-5H;; ZPLIKENUWGCSRI-UHFFFAOYSA-N
url	https://doi.org/10.5281/zenodo.19144148