Formula |
C12H15N3OS |
IUPAC Name |
1-(1,2-benzothiazol-3-yl)-3-butyl-urea |
Molecular Mass |
249.332 g·mol−1 |
Heat of Formation |
-55.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.56 ± 1.08 D |
Volume |
297.03 Å 3 |
Surface Area |
282.29 Å 2 |
HOMO Energy |
-8.49 ± 0.55 eV |
LUMO Energy |
-0.94 ± eV |
Point Group Symmetry |
C1
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Synonyms
|
- 3-(1,2-benzothiazol-3-yl)-1-butyl-urea
- 3-(1,2-benzothiazol-3-yl)-1-butylurea
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CAS Number(s) |
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InChIKey |
KETPEDRTSXCYFB-UHFFFAOYSA-N |
QR Code |
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Links |
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Downloads |
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Elements |
H
S
C
O
N
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