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Dibenzo(3,4:7,8)cycloocta(1,2-D:5,6-D')bis(1,2,3)selenadiazole
SpectraBase Compound ID 7Z3cCasdE0a
InChI InChI=1S/C16H8N4Se2/c1-3-7-11-9(5-1)13-16(22-19-17-13)12-8-4-2-6-10(12)14-15(11)21-20-18-14/h1-8H/b13-9+,14-10+,15-11+,16-12+
InChIKey XXJPYBLCQOCYLN-KUWVSJDVSA-N
Mol Weight 414.21 g/mol
Molecular Formula C16H8N4Se2
Exact Mass 415.90794 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FI0QsHaTM4G
Name Dibenzo(3,4:7,8)cycloocta(1,2-D:5,6-D')bis(1,2,3)selenadiazole
CAS Registry Number 79448-66-1
Comments HX-90 OR WP-80, SHIFTS PARTIALLY ASSIGNED BY T.E.
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C16H8N4Se2
InChI InChI=1S/C16H8N4Se2/c1-3-7-11-9(5-1)13-16(22-19-17-13)12-8-4-2-6-10(12)14-15(11)21-20-18-14/h1-8H/b13-9+,14-10+,15-11+,16-12+
InChIKey XXJPYBLCQOCYLN-KUWVSJDVSA-N
Instrument Name Bruker HX-90
Literature Reference H. Meier, J. Zountsas, O. Zimmer, Z. Naturforsch. 36B, 1017 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3