Formula |
C7H7N3O2S2 |
IUPAC Name |
methyl n-[4-(isothiocyanatomethyl)thiazol-2-yl]carbamate |
Molecular Mass |
229.279 g·mol−1 |
Heat of Formation |
-24.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.99 ± 1.08 D |
Volume |
250.76 Å 3 |
Surface Area |
248.3 Å 2 |
HOMO Energy |
-8.88 ± 0.55 eV |
LUMO Energy |
-1.28 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- methyl (4-(isothiocyanatomethyl)-2-thiazolyl)carbamate
- methyl n-[4-(isothiocyanatomethyl)-1,3-thiazol-2-yl]carbamate
- methyl scnmtc
- n-[4-(isothiocyanatomethyl)thiazol-2-yl]carbamic acid methyl ester
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CAS Number(s) |
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InChIKey |
BEPWEXWVYZWWNC-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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