Density Functional Theory calculations, a computational method used to study the electronic structure and properties of molecules.
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4-(phenylthio)isoquinoline
7-Azaindole
iodomethane
Silane, trimethyl[(1E)-2-[(R)-(4-methylphenyl)sulfinyl]ethenyl]-
Benzaldehyde
Toluene
[Ni(2,2':6',6''-terpyridine)(2,4,6-trimethylphenyl)]PF6
3-benzyloxy-1-bromo-3H-pyrazolo[3,4-c]isoquinoline
(4-bromo-3,5-bis-dimethylaminomethyl-phenyl)-dimethyl-amine
Benzyl bromide
18-Crown-6
[ZnN4C20H6C(CN)2(C6H3(C(CH3)3)2)2]2
[Zn(3-AP)(TPP)]
C11H15BO
N-benzoyl-N',N''-bis(4-phenylpiperazinyl) phosphoric triamide
5-(diphenylamino)-2,4-pentadiyne-1-ol
Benzenamine, N-ethynyl-N-phenyl-
4-[(2-decyl)?2H-tetrazol-5-yl]phenyl acetate
4-Cyanophenol
1-Bromooctane
benzaldehyde N,N-dimethyl-N-(p-bromobenzyl)hydrazonium bromide
3H-Diazirin-3-ol, 3-(phenoxymethyl)-, acetate (ester)
Benzoic acid, 4-[2-(1-hexynyl)-1,3-dithiolan-2-yl]-, methyl ester
5-<(E)-α-Chlorbenzyliden>-6,6-dimethylbicyclo<2.2.2>oct-2-en
C14H12ClF3O5S
