Formula |
C25H27N3O3S |
IUPAC Name |
1-(2,6-diisopropylphenyl)-3-[4-(4-nitrophenyl)sulfanylphenyl]urea |
Molecular Mass |
449.565 g·mol−1 |
Heat of Formation |
-33.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
8.49 ± 1.08 D |
Volume |
545.57 Å 3 |
Surface Area |
464.75 Å 2 |
HOMO Energy |
-8.76 ± 0.55 eV |
LUMO Energy |
1.75 ± eV |
Point Group Symmetry |
C1
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Synonyms
|
- 1-(2,6-diisopropylphenyl)-3-[4-[(4-nitrophenyl)thio]phenyl]urea
|
InChIKey |
XFFITGBWVLQNCD-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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