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Powder X-ray data for melatonin C13H16N2O2

Published online by Cambridge University Press:  10 January 2013

Ruggero Caminiti ,
Giancarlo Ortaggi ,
Raffaele Antonio Mazzei ,
Paolo Ballirano  and
Rita Rizzi
Ruggero Caminiti*
Affiliation:
Dipartimento di Chimica, Istituto Nazionale per la Fisica della Materia, Università di Roma “La Sapienza,” Piazzale Aldo Moro 5, Roma, I-00185, Italy
Giancarlo Ortaggi
Affiliation:
Dipartimento di Chimica, Istituto Nazionale per la Fisica della Materia, Università di Roma “La Sapienza,” Piazzale Aldo Moro 5, Roma, I-00185, Italy
Raffaele Antonio Mazzei
Affiliation:
Dipartimento di Chimica, Istituto Nazionale per la Fisica della Materia, Università di Roma “La Sapienza,” Piazzale Aldo Moro 5, Roma, I-00185, Italy
Paolo Ballirano
Affiliation:
Dipartimento di Scienze della Terra, Università di Roma “La Sapienza,” Piazzale Aldo Moro 5, Roma, I-00185, Italy
Rita Rizzi
Affiliation:
RF snc, Via Larga 47, Bologna, I-40138, Italy
*
a)Author to whom correspondence should be addressed. Electronic mail: [email protected]
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Abstract

Powder X-ray diffraction data of melatonin C13H16N2O2 were collected on a conventional X-ray powder diffractometer: the monoclinic cell parameter are a=7.7416(8) Å, b=9.2897(9) Å, c=17.1444(16) Å, β=96.756(9)°, volume 1224.4(3) Å3 (space group P21/c). The strongest lines are (d (Å), I/I0) 8.161 (100), 5.411 Å (46), 3.412 Å (34), 4.668 Å (33), 4.645 Å (25), 3.554 Å (22), 3.668 Å (16), and 4.483 Å (14). Reported intensities are validated by Rietveld analysis. The data consist of measured positions and intensities and cover an angular range up to 60° 2θ: experimental, calculated, and difference patterns are also reported.

Keywords

melatoninC13H16N2O2,Rietveld refinementpowder diffraction
Type
New Diffraction Data
Information
Powder Diffraction , Volume 15 , Issue 2 , June 2000 , pp. 108 - 111
Copyright
Copyright © Cambridge University Press 2000

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