73 TS for cis geometry suprafacial, N epimer G = -648.951789 (vs G = -648.933983 for NH isomer ) DG = 27.84 IRC

Imperial College Research Computing Service Data Repository 2026 Dataset Open access

Read full text
Authors: Henry Rzepa
DOI: 10.14469/hpc/15960
Cited by: 2

Publication details

Journal / source
Imperial College Research Computing Service Data Repository
Publication date
1 January 2026
Document type
Dataset