Formula |
C24H36IN3O3 |
IUPAC Name |
tert-butyl n-[3-[3-[[4-(diethylamino)-1-piperidyl]methyl]-4-hydroxy-5-iodo-phenyl]prop-2-ynyl]carbamate |
Molecular Mass |
541.465 g·mol−1 |
Heat of Formation |
-287.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.88 ± 1.08 D |
Volume |
584.12 Å 3 |
Surface Area |
509.53 Å 2 |
HOMO Energy |
-8.58 ± 0.55 eV |
LUMO Energy |
2.47 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
FCYRMDPXMJYHRX-UHFFFAOYSA-N |
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Elements |
I
H
C
O
N
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