Crystallography Open Database

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Searching journal of publication like 'crystengcomm'

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7251402 CIFC13 H13 N3 O6P -15.8889; 10.2677; 11.2466
102.25; 93.673; 91.141		662.79Kanagavel, Manimurugan; Nechipadappu, Sunil Kumar
Structural insights into the multi-component solid forms of aminocaproic acid and aminomethyl benzoic acid: mechanochemical approach for the preparation of salt forms
CrystEngComm, 2026
7251403 CIFC36 H60.19 N3 O16.6P -17.5263; 12.781; 21.505
77.876; 88.418; 79.491		1988.5Kanagavel, Manimurugan; Nechipadappu, Sunil Kumar
Structural insights into the multi-component solid forms of aminocaproic acid and aminomethyl benzoic acid: mechanochemical approach for the preparation of salt forms
CrystEngComm, 2026
7251407 CIFC5 H9 N3 O3P -14.1764; 7.4068; 12.223
90.144; 97.506; 91.316		374.76Raičević, Vidak; Radulović, Niko S.; Banić, Nemanja; Leovac, Vukadin M.; Rodić, Marko V.
Competing hydrogen bonding and acyclic π-stacking between hydrogen-bridged quasi-rings in Z- and E-methyl pyruvate semicarbazone: a quantitative interaction energy analysis
CrystEngComm, 2025, 27, 7721-7733
7251408 CIFC5 H9 N3 O3F d d 236.4109; 23.9057; 7.0463
90; 90; 90		6133.3Raičević, Vidak; Radulović, Niko S.; Banić, Nemanja; Leovac, Vukadin M.; Rodić, Marko V.
Competing hydrogen bonding and acyclic π-stacking between hydrogen-bridged quasi-rings in Z- and E-methyl pyruvate semicarbazone: a quantitative interaction energy analysis
CrystEngComm, 2025, 27, 7721-7733
9017408 CIFC Ca O3P 657.112; 7.112; 25.4089
90; 90; 120		1113.01Demichelis, R.; Raiteri, P.; Gale, J. D.; Dovesi, R.
A new structural model for disorder in vaterite from first-principles calculations
CrystEngComm, 2012, 14, 44-47

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All data in the COD and the database itself are dedicated to the public domain and licensed under the CC0 License . Users of the data should acknowledge the original authors of the structural data.