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- Title
Crystal Structure and Hirshfeld Surface Analysis of 3-(pyrrolidine-1-carbonyl)-2H-Chromen-2-One.
- Authors
Odame, F.; Madanhire, T.; Hosten, E. C.
- Abstract
The crystal X-ray structure of 3-(pyrrolidine-1-carbonyl)-2H-chromen-2-one (1) has been presented. The compound crystallizes in the triclinic space group with two molecules in the unit cell characterized by unit cell parameters a = 7.8547(5) Å, b = 9.0159(5) Å, c = 9.1516(5) Ǻ, α = 76.623(2)°, β = 89.546(3)° and γ = 67.626(2)°. The experimental bond lengths and bond angles have been compared with DFT computed results. The Hirshfeld surface analysis of the compound has been presented.
- Subjects
SURFACE analysis; CRYSTAL structure; SURFACE structure; UNIT cell; SPACE groups
- Publication
Journal of Structural Chemistry, 2024, Vol 65, Issue 7, p1305
- ISSN
0022-4766
- Publication type
Article
- DOI
10.1134/S0022476624070035