[1] Chen, Z. †; Tan, M. †; Shan, C. †; Yuan, X.; Chen, L.; Shi, J.; Lan, Y.; Li, Y.*Aryne 1,4-Disubstitution and Remote Diastereoselective 1,2,4-Trisubstitution via a Nucleophilic Annulation-[5,5]-Sigmatropic Rearrangement Process. Angew. Chem.Int. Ed. 2022, e202212160. (†co-first author)

[2] Li, L.†; Shan, C.†; Shi, J.; Li, W.; Lan, Y.*; Li, Y.* The Stannum-Ene Reactions of Benzyne and Cyclohexyne with Superb Chemoselectivity for Cyclohexyne. Angew. Chem. Int. Ed. 2022, e202117351. (†co-first author)

[3] Gong, W.; Fu, D.; Zhong, K.; Ni, H.; He, X.; Shan, C.*, Li, R.*; Lan, Y.* What is the difference between mono- and biphosphine ligands? Revealing the chemoselectivity in Pd-catalysed carbenation of bromonaphthalene. Org. Chem. Front. 2022, 9, 4916-4923.

[4] Shi, J.†; Li, L.†; Shan, C.†; Wang, J.; Chen, Z.; Gu, R.; He, J.; Tan, M.; Lan, Y.*; Li, Y.* Aryne 1,2,3,5-Tetrasubstitution Enabled by 3‑Silylaryne and Allyl Sulfoxide via an Aromatic 1,3-Silyl Migration. J. Am. Chem. Soc. 2021, 143, 2178-2184. (†co-first author)

[5] Shi, J.†; Li, L.†; Shan, C.†; Wang, J.; Chen, Z.; Gu, R.; He, J.; Tan, M.; Lan, Y.*; Li, Y.* Benzyne 1,2,4-Trisubstitution and Dearomative 1,2,4-Trifunctionalization. J. Am. Chem. Soc. 2021, 143, 10530-10536. (†co-first author)

[6] He, X. ; Zhu, L.; Heng, D.; Liu, F.; Liu, S.; Zhong, K.; Shan, C.*; Bai, R.*; Lan, Y.* Mechanistic insights into the rhodium–copper cascade catalyzed dual C–H annulation of indoles. Org. Chem. Front. 2021, 8, 1739-1746.

[7] Zhong, K. †; Shan, C. †; Zhu, L.; Liu, S.; Zhang, T.; Liu, F.; Shen, B.; Lan, Y.; Bai, R. Direct Nucleophilic Addition of Cu–carbene to Acetylene to Construct Chiral Allenes: A Mechanism Study Encouraged by Density Functional Theory Calculations. J. Am. Chem. Soc. 2019, 141, 5772-5780. (†co-first author)

[8] Shan, C.; Zhang, T.; Xiong, Q.; Yan, H.; Bai, R.; Lan, Y. Hydrogen‐bond‐induced chiral axis construction: theoretical study of cinchonine‐thiourea‐catalyzed enantioselective intramolecular cycloaddition. Chem. Asian J. 2019, 14, 2731-2736.

[9] Shan, C.; Bai, R.; Lan, Y. Theoretical Advances of Transition Metals Mediated C–H Bonds Cleavage. Acta Phys. -Chim. Sin. 2019, 35, 940–953.

[10] Shan, C.;Zhu, L.; Qu, L.-B.; Bai, R.; Lan, Y. Mechanistic view of Ru-catalyzed C–H bond activation and functionalization: computational advances. Chem. Soc. Rev. 2018, 47, 7497-7820.

[11] Shan, C.; Zhong, K.; Qi, X.; Xu, D.; Qu, L-B.; Bai, R.; Lan, Y. Long distance unconjugated agostic-assisted 1,5-H shift in a Ru-mediated Alder-ene type reaction: mechanism and stereoselectivity. Org. Chem. Front. 2018, 5, 3178-3185.

[12] Shan, C.; Luo, X.; Qi, X.; Liu, S.; Li, Y.; Lan, Y. Mechanism of ruthenium-catalyzed direct arylation of C–H bonds in aromatic amides: A computational study. Organometallics2016, 35, 1440-1445.

[13] Li, Y. †; Shan, C. †; Yang, Y.; Shi, F. Qi, X.; Houk, K.; Lan, Y. Mechanism, Regio-, and Diastereoselectivity of Rh(III)-catalyzed Cyclization Reaction of N-Arylnitrones with Alkynes: A DFT study. J. Phys. Chem. A 2017, 121, 4496–4504. (†co-first author)

[14] 徐冬冬†, 单春晖†, 白若鹏, 蓝宇. 碱土金属催化碳二亚胺硼氢化反应机理的理论研究[J]. 有机化学. 2017, 37, 1231-1236. (†共同一作)

[15] 何晓倩†, 单春晖†, 戚孝天, 白若鹏, 蓝宇. 亚铜催化芳基硼酸三氟甲基化反应的理论研究[J].中国科学:化学. 2017,47, 859-864. (†共同一作)