4-(6-{[(Trans-4-Methylcyclohexyl)Amino]Methyl}-1,4-Dihydroindeno[1,2-C]Pyrazol-3-Yl)Benzoic Acid
Properties
Property | Value |
---|---|
Formula | C25H27N3O2 |
IUPAC Name | 4-[6-[[(4-methylcyclohexyl)amino]methyl]-1,4-dihydroindeno[1,2-c]pyrazol-3-yl]benzoic acid |
Molecular Mass | 401.501 g·mol−1 |
Heat of Formation | -35.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.08 ± 1.08 D |
Volume | 492.02 Å 3 |
Surface Area | 436.59 Å 2 |
HOMO Energy | -9.00 ± 0.55 eV |
LUMO Energy | -1.15 ± eV |
Point Group Symmetry | C1 |
InChIKey | MEDLHZCDTXWLOC-SGNKCFNYSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
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Elements | H C O N |