Formula |
C23H22N4O |
IUPAC Name |
(2s)-1-(7h-indol-1-ium-7-id-3-yl)-3-[[5-[(e)-2-(4-pyridyl)vinyl]-3-pyridyl]oxy]propan-2-amine |
Molecular Mass |
370.447 g·mol−1 |
Heat of Formation |
320.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.17 ± 1.08 D |
Volume |
456.16 Å 3 |
Surface Area |
412.24 Å 2 |
HOMO Energy |
-8.66 ± 0.55 eV |
LUMO Energy |
-1.18 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (1s)-2-(1h-indol-3-yl)-1-[({5-[(e)-2-pyridin-4-ylvinyl]pyridin-3-yl}oxy)methyl]ethylamine
- (2s)-1-(1h-indol-3-yl)-3-[5-[(e)-2-pyridin-4-ylethenyl]pyridin-3-yl]oxy-propan-2-amine
- (2s)-1-(1h-indol-3-yl)-3-[5-[(e)-2-pyridin-4-ylethenyl]pyridin-3-yl]oxypropan-2-amine
- (2s)-1-(1h-indol-3-yl)-3-[[5-[(e)-2-(4-pyridyl)vinyl]-3-pyridyl]oxy]propan-2-amine
- 4ea
- [(1s)-1-(1h-indol-3-ylmethyl)-2-[[5-[(e)-2-(4-pyridyl)vinyl]-3-pyridyl]oxy]ethyl]amine
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InChIKey |
SGHXFHRRWFLILP-XJDXJNMNSA-N |
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Elements |
H
C
O
N
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