| Formula |
C17H25N3O2S |
| IUPAC Name |
n,n-dimethyl-2-[5-(pyrrolidin-1-ylsulfonylmethyl)indol-1-ium-3-yl]ethanamine |
| Molecular Mass |
335.464 g·mol−1 |
| Heat of Formation |
-213.4 ± 16.7 kJ·mol−1 |
| Dipole Moment |
5.29 ± 1.08 D |
| Volume |
410.68 Å 3 |
| Surface Area |
343.64 Å 2 |
| HOMO Energy |
-8.34 ± 0.55 eV |
| LUMO Energy |
-0.06 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- almogran
- almotriptan (usan)
- d02824
- dimethyl-[2-[5-(pyrrolidin-1-ylsulfonylmethyl)-1h-indol-3-yl]ethyl]amine
- las-31416
- n,n-dimethyl-2-[5-(1-pyrrolidinylsulfonylmethyl)-1h-indol-3-yl]ethanamine
- n,n-dimethyl-2-[5-(pyrrolidin-1-ylsulfonylmethyl)-1h-indol-3-yl]ethanamine
- pnu-180638
|
| CAS Number(s) |
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| InChIKey |
WKEMJKQOLOHJLZ-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
Wikipedia
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|
| DOI |
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| Downloads |
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|
| Elements |
H
S
C
O
N
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