| Formula |
C14H21N5O2S |
| IUPAC Name |
(6-propylsulfanylpurin-9-ium-9-yl)methyl n-butylcarbamate |
| Molecular Mass |
323.414 g·mol−1 |
| Heat of Formation |
-184.0 ± 16.7 kJ·mol−1 |
| Dipole Moment |
2.99 ± 1.08 D |
| Volume |
387.86 Å 3 |
| Surface Area |
366.81 Å 2 |
| HOMO Energy |
-8.57 ± 0.55 eV |
| LUMO Energy |
2.03 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- (6-propylsulfanylpurin-9-yl)methyl n-butylcarbamate
- n-butylcarbamic acid [6-(propylthio)-9-purinyl]methyl ester
- n-butylcarbamic acid [6-(propylthio)purin-9-yl]methyl ester
|
| CAS Number(s) |
|
| InChIKey |
ONBGMWLHMNYGKS-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
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|
| DOI |
|
| Downloads |
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|
| Elements |
H
S
C
O
N
|
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