Formula |
C6H10N4S |
IUPAC Name |
2-(2-imidazol-3-ium-4-ylium-4-ylethyl)isothiourea |
Molecular Mass |
170.235 g·mol−1 |
Heat of Formation |
180.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.00 ± 1.08 D |
Volume |
203.94 Å 3 |
Surface Area |
200.65 Å 2 |
HOMO Energy |
-9.01 ± 0.55 eV |
LUMO Energy |
2.53 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-(1h-imidazol-4-yl)ethyl carbamimidothioate
- 2-(3h-imidazol-4-yl)ethylsulfanylformamidine
- 2-(3h-imidazol-4-yl)ethylsulfanylmethanimidamide
- [2-(3h-imidazol-4-yl)ethylthio]formamidine
- carbamimidothioic acid, 2-(1h-imidazol-4-yl)ethyl ester
- s-(2-(4-imidazolyl)ethyl)isothiourea
- tocris-0729
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CAS Number(s) |
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InChIKey |
PEHSVUKQDJULKE-UHFFFAOYSA-N |
QR Code |
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Links |
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Downloads |
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Elements |
H
S
C
N
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