Formula |
C21H26BrN3O |
IUPAC Name |
(6ar,9r)-5-bromo-n,n-diethyl-4,7-dimethyl-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide |
Molecular Mass |
416.355 g·mol−1 |
Heat of Formation |
26.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.33 ± 1.08 D |
Volume |
457.58 Å 3 |
Surface Area |
380.5 Å 2 |
HOMO Energy |
-8.14 ± 0.55 eV |
LUMO Energy |
-0.31 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 1-methyl-2-bromlysergic acid diethylamide
- ergoline-8-beta-carboxamide, 2-bromo-9,10-didehydro-n,n-diethyl-1,6-dimethyl-
- mbl-61
- n(1)-methyl-2-bromo-lysergic acid diethylamide
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CAS Number(s) |
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InChIKey |
KLMFUBCMJSPRPY-FZKQIMNGSA-N |
QR Code |
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Links |
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Downloads |
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Elements |
H
C
O
Br
N
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