| Formula |
C20H20N6S4 |
| IUPAC Name |
1-(3-isothiocyanatophenyl)-3-[4-[(3-isothiocyanatophenyl)carbamothioylamino]butyl]thiourea |
| Molecular Mass |
472.673 g·mol−1 |
| Heat of Formation |
595.4 ± 16.7 kJ·mol−1 |
| Dipole Moment |
11.04 ± 1.08 D |
| Volume |
553.56 Å 3 |
| Surface Area |
405.1 Å 2 |
| HOMO Energy |
-8.56 ± 0.55 eV |
| LUMO Energy |
-1.06 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 1,4-di[3-(3-isothiocyanatophenyl)thioureido]butane
- 3-(3-isothiocyanatophenyl)-1-[4-[(3-isothiocyanatophenyl)carbamothioylamino]butyl]thiourea
- 3-(3-isothiocyanatophenyl)-1-[4-[(3-isothiocyanatophenyl)thiocarbamoylamino]butyl]thiourea
- 3-(3-isothiocyanatophenyl)-1-[4-[[[(3-isothiocyanatophenyl)amino]-thioxomethyl]amino]butyl]thiourea
- mrs 2578
|
| InChIKey |
QOHNRGHTJPFMSL-UHFFFAOYSA-N |
| QR Code |
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| Links |
PubChem
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|
| DOI |
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| Downloads |
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|
| Elements |
H
S
C
N
|
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