Formula |
C13H9NO4 |
IUPAC Name |
8-methoxy-3-nitro-2-oxatricyclo[7.3.1.05,13]trideca-1(12),3,5,7,9(13),10-hexaene |
Molecular Mass |
243.215 g·mol−1 |
Heat of Formation |
-66.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.37 ± 1.08 D |
Volume |
262.91 Å 3 |
Surface Area |
245.66 Å 2 |
HOMO Energy |
-8.68 ± 0.55 eV |
LUMO Energy |
1.39 ± eV |
Point Group Symmetry |
C1
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Synonyms
|
- 6-methoxy-2-nitronaphtho(1,8-bc)pyran
- naphtho(1,8-bc)pyran, 6-methoxy-2-nitro-
- r 7779
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CAS Number(s) |
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InChIKey |
DNZYLXTVVJFKQE-UHFFFAOYSA-N |
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Links |
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Elements |
H
C
O
N
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