Formula |
C25H35NO4S |
IUPAC Name |
5-(3,3-dimethylbut-1-ynyl)-3-[(4-hydroxycyclohexyl)-(4-methylcyclohexanecarbonyl)amino]thiophene-2-carboxylic acid |
Molecular Mass |
445.615 g·mol−1 |
Heat of Formation |
-695.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.68 ± 1.08 D |
Volume |
563.04 Å 3 |
Surface Area |
462.42 Å 2 |
HOMO Energy |
-8.87 ± 0.55 eV |
LUMO Energy |
-1.71 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
WPMJNLCLKAKMLA-VVPTUSLJSA-N |
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Links |
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Downloads |
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Elements |
H
S
C
O
N
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