Formula |
C25H33N3O |
IUPAC Name |
(2r)-2-butyl-11-[(z)-[(5z)-3-methoxy-5-pyrrol-2-ylidene-pyrrol-2-ylidene]methyl]-10-azabicyclo[7.2.1]dodeca-1(11),9(12)-diene |
Molecular Mass |
391.549 g·mol−1 |
Heat of Formation |
164.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.87 ± 1.08 D |
Volume |
512.79 Å 3 |
Surface Area |
401.41 Å 2 |
HOMO Energy |
-8.09 ± 0.55 eV |
LUMO Energy |
-1.41 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
JFJGSGABCGVJGJ-YMTDNPRJSA-N |
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Elements |
H
C
O
N
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