Formula |
C16H15ClN2O2 |
IUPAC Name |
(4s,5r)-8-chloro-3'-methyl-4-(methylamino)spiro[3,4-dihydrobenzo[cd]indol-1-ium-5,5'-furan]-2'-one |
Molecular Mass |
302.756 g·mol−1 |
Heat of Formation |
-119.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.16 ± 1.08 D |
Volume |
337.25 Å 3 |
Surface Area |
292.5 Å 2 |
HOMO Energy |
-8.71 ± 0.55 eV |
LUMO Energy |
-0.66 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 8-chlororugulovasine a
- spiro(benz(cd)indole-5(1h),2'(5'h)-furan)-5'-one, 3,4-dihydro-8-chloro-4'-methyl-4-(methylamino)-, cis-(+-)-
- toxin b (penicillium islandicum)
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CAS Number(s) |
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InChIKey |
SDYOUVJWVNBXPX-BLLLJJGKSA-N |
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Links |
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Downloads |
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Elements |
H
C
N
O
Cl
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