Results 71 to 80 of about 14,177,191 (172)

Magnetic Coupling in Non-Kekulé Diradical Hydrocarbons via Multiconfigurational Pair-Density Functional Theory. [PDF]

J Chem Theory Comput
Rodrigues GLS, Delcey MG, Solomon GC, Hedegård ED, Leitherer S.   +4 more
europepmc   +1 more source

Impacts of Quinone Structure on Trade-Offs Between Redox Potential and CO₂ Binding Strength. [PDF]

Chemphyschem
Taylor JS, Forse AC, Thom AJW.
europepmc   +1 more source

Enumeration of Kekulé structures in defective patterns of rectangular graphite

, 2006
István Lukovits
openalex   +1 more source

Computing the Kekulé structure count for alternant hydrocarbons [PDF]

, 2002
Francisco Torrens
openalex   +1 more source

A Riboflavin-Derived Flavinium Salt Mediates Chemoselective Methylation Reactions. [PDF]

Chemistry
Langschwager T, Suylu E, Zuber J, Storch G.   +3 more
europepmc   +1 more source

Binary coding of algebraic Kekulé structures of catacondensed benzenoid graphs

, 2007
Damir Vukičević, Petra Žigert
openalex   +2 more sources

Carbon-based molecular qubits: a chemical pathway to ambient quantum technologies. [PDF]

Natl Sci Rev
Imran M, Qiu ZL, Ma J, Feng X.
europepmc   +1 more source

Arene activation via π-bond localization: concepts and opportunities. [PDF]

Beilstein J Org Chem
Meiners P, Melder JJ, Morack T.
europepmc   +1 more source

Grammar-driven SMILES standardization with <i>TokenSMILES</i>. [PDF]

Chem Sci
Gonzalez-Ortiz LA, Noriega L, Ortiz-Chi F, Vidales-Ayala G, Soberanis-Cáceres E, Meneses-Viveros A, Aspuru-Guzik A, Merino G.   +7 more
europepmc   +1 more source

A₂Se₂C₂ (A = Na-Cs): crystalline compounds featuring ^-Se-C[triple bond, length as m-dash]C-Se^- dianions with short-range structural disorder. [PDF]

RSC Adv
Mattick T, Hetzert M, Ruschewitz U.
europepmc   +1 more source