Formula |
C31H50O2 |
IUPAC Name |
but-1-yn-1-olate; (5z)-4-methylene-5-[2-[3-methyl-2-[2-[2-[2-(2-methylcyclopropen-1-yl)ethynyl]cyclopropen-1-yl]ethynyl]benzene-4,5,6-triid-1-yl]ethylidene]cyclohex-2-en-1-one |
Molecular Mass |
454.727 g·mol−1 |
Heat of Formation |
5066.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.83 ± 1.08 D |
Volume |
445.24 Å 3 |
Surface Area |
340.85 Å 2 |
HOMO Energy |
-8.58 ± 0.55 eV |
LUMO Energy |
-0.94 ± eV |
Point Group Symmetry |
C1
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InChIKey |
QUUDUVNKJWQDFG-NMTNLUFNSA-N |
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Links |
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DOI |
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Elements |
H
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O
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