Formula |
C23H25N3O4 |
IUPAC Name |
methyl 5-[6-[[(4-hydroxycyclohexyl)amino]methyl]-2,4-dihydroindeno[1,2-c]pyrazol-3-yl]furan-2-carboxylate |
Molecular Mass |
407.462 g·mol−1 |
Heat of Formation |
-269.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.02 ± 1.08 D |
Volume |
481.99 Å 3 |
Surface Area |
430.59 Å 2 |
HOMO Energy |
-8.99 ± 0.55 eV |
LUMO Energy |
-0.96 ± eV |
Point Group Symmetry |
C1
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InChIKey |
MCIHIBVPUQANQG-IYBDPMFKSA-N |
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Elements |
H
C
O
N
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