Formula |
C24H27N3O2++ |
IUPAC Name |
ethylene; n'-[[4-[3-(4h-isoquinolin-2-ium-4-id-7-yl)prop-2-ynoxy]-2-methoxy-phenyl]methyl]ethane-1,2-diamine |
Molecular Mass |
389.490 g·mol−1 |
Heat of Formation |
251.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.97 ± 1.08 D |
Volume |
506.28 Å 3 |
Surface Area |
455.3 Å 2 |
HOMO Energy |
-8.82 ± 0.55 eV |
LUMO Energy |
-1.18 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
SSBLXEABMBMHKV-UHFFFAOYSA-P |
QR Code |
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Links |
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Elements |
H
C
O
N
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