Formula |
C12H18N4S2 |
IUPAC Name |
2-[2-[3-(2-carbamimidoylsulfanylethyl)phenyl]ethyl]isothiourea |
Molecular Mass |
282.428 g·mol−1 |
Heat of Formation |
191.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.79 ± 1.08 D |
Volume |
347.69 Å 3 |
Surface Area |
326.39 Å 2 |
HOMO Energy |
-8.92 ± 0.55 eV |
LUMO Energy |
2.42 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-[3-(2-carbamimidoylsulfanylethyl)phenyl]ethylsulfanylformamidine
- 2-[3-(2-carbamimidoylsulfanylethyl)phenyl]ethylsulfanylmethanimidamide
- 2-{2-[3-(2-carbamimidoylsulfanyl-ethyl)-phenyl]-ethyl}-isothiourea
- 3bt
- [2-[3-[2-(amidinothio)ethyl]phenyl]ethylthio]formamidine
- [2-[3-[2-(carbamimidoylthio)ethyl]phenyl]ethylthio]formamidine
- hsci1_000311
- s,s'-(1,3-phenylene-bis(1,2-ethanediyl))bis-isothiourea
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InChIKey |
YEUSLPIIQGZHQB-UHFFFAOYSA-N |
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Links |
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Downloads |
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Elements |
H
C
S
N
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