Formula |
C6H11NO2S2 |
IUPAC Name |
1-isothiocyanato-4-methylsulfonyl-butane |
Molecular Mass |
193.287 g·mol−1 |
Heat of Formation |
-255.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
9.04 ± 1.08 D |
Volume |
226.84 Å 3 |
Surface Area |
224.53 Å 2 |
HOMO Energy |
-8.83 ± 0.55 eV |
LUMO Energy |
-0.19 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 1-isothiocyanato-4-methylsulfonylbutane
- 4-mesylbutylimino-thioxo-methane
- butane, 1-isothiocyanato-4-(methylsulfonyl)-
- erysolin
- erysoline
- sdccgmls-0066701.p001
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CAS Number(s) |
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InChIKey |
WNCZPWWLBZOFJL-UHFFFAOYSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
H
S
C
O
N
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