10.14469/HPC/10076
Rzepa, Henry
Henry
Rzepa
https://orcid.org/0000-0002-8635-8390
Imperial College London
C 15 H 29 Br 1 Cl 1 O 5 1
Imperial College London
2022
Results
InChI=1S/C13H21BrClO3.CH4O/c1-7-5-13-10(15)6-12(18-13)9(14)3-4-11(16)8(2)17-7;1-2/h4,7-13,16H,3,5-6H2,1-2H3;2H,1H3/t7-,8+,9+,10-,11-,12+,13-;/m1./s1
XIUVHPIYONGYIF-YUTAABOWSA-N
Imperial College London
Imperial College Research Computing Service
Rzepa, Henry
Henry
Rzepa
https://orcid.org/0000-0002-8635-8390
Imperial College London
2022
https://data.hpc.imperial.ac.uk/resolve/?ore=10076
https://data.hpc.imperial.ac.uk/resolve/?doi=10076&file=1
10.14469/hpc/10062
Creative Commons Zero v1.0 Universal
9...HOMe X-ray conformation methanol TS Def2-TZVPPD + MeOH solvent