Browse Collection: Phosphoranyl cyanolutidine SET Phosphoranyl cyanolutidine SET https://iochem-bd.bsc.es/browse/handle/100/491078 2026-04-07T21:30:53Z 2026-04-07T21:30:53Z /single points CNLutH_c SP Limburg, Bart Dmitriev, Igor https://iochem-bd.bsc.es/browse/handle/100/491097 2026-03-18T15:33:14Z 2026-03-18T15:33:10Z Title: /single points CNLutH_c SP Authors: Limburg, Bart; Dmitriev, Igor Abstract: single point for 4-cyano-2,6-lutidinium 2026-03-18T15:33:10Z /opt + freq CNLutH_c opt Limburg, Bart Dmitriev, Igor https://iochem-bd.bsc.es/browse/handle/100/491096 2026-03-18T15:33:14Z 2026-03-18T15:33:10Z Title: /opt + freq CNLutH_c opt Authors: Limburg, Bart; Dmitriev, Igor Abstract: geometry optimization for 4-cyano-2,6-lutidinium 2026-03-18T15:33:10Z /single points CNLut_ra SP Limburg, Bart Dmitriev, Igor https://iochem-bd.bsc.es/browse/handle/100/491095 2026-03-17T12:45:44Z 2026-03-17T12:39:32Z Title: /single points CNLut_ra SP Authors: Limburg, Bart; Dmitriev, Igor Abstract: single point for the radical anion of 4-cyano-2,6-lutidine 2026-03-17T12:39:32Z /TS A to B TS SP Limburg, Bart Dmitriev, Igor https://iochem-bd.bsc.es/browse/handle/100/491092 2026-03-17T12:45:44Z 2026-03-17T12:39:32Z Title: /TS A to B TS SP Authors: Limburg, Bart; Dmitriev, Igor Abstract: Single point for the deprotonation TS from A to B 2026-03-17T12:39:32Z