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Collection hits:
Collection Name
Chiral 5-membered carbocycles
Item hits:
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required8-Apr-2026(R)-TS1-S-PH2Arenas Baeza, Carmen MaríaGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRwB97XDLANL2DZ 6-31G(D,P) GENECP-2344.47023857; Eh
Login required8-Apr-2026(R)-TS1-R-PH2Arenas Baeza, Carmen MaríaGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRwB97XDLANL2DZ 6-31G(D,P) GENECP-2344.47166193; Eh
Login required8-Apr-2026(R)-TS1-RFArenas Baeza, Carmen MaríaGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRwB97XDLANL2DZ 6-31G(D,P) GENECP-3268.45356006; Eh
Login required8-Apr-2026(R)-TS1-SAArenas Baeza, Carmen MaríaGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRwB97XDLANL2DZ 6-31G(D,P) GENECP-3268.45131970; Eh
Login required8-Apr-2026(R)-TS1-REArenas Baeza, Carmen MaríaGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRwB97XDLANL2DZ 6-31G(D,P) GENECP-3268.44492473; Eh
Login required8-Apr-2026(R)-TS1-SBArenas Baeza, Carmen MaríaGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XDLANL2DZ 6-31G(D,P) GENECP-3268.44057008; Eh
Login required8-Apr-2026(R)-TS1-SCArenas Baeza, Carmen MaríaGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XDLANL2DZ 6-31G(D,P) GENECP-3268.45522360; Eh
Login required8-Apr-2026(R)-1a-2Arenas Baeza, Carmen MaríaGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRwB97XD6-31G(D,P) GENECP-1067.80263115; Eh
Login required8-Apr-2026(R)-1a-1Arenas Baeza, Carmen MaríaGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRwB97XD6-31G(D,P) GENECP-1067.80340770; Eh
Results 2711-2720 of 2835 (Search time: 0.001 seconds).