Formula |
C27H38N2O++ |
IUPAC Name |
allyl-[4-[5-[4-[allyl(dimethyl)ammonio]phenyl]-3-oxo-pentyl]phenyl]-dimethyl-ammonium |
Molecular Mass |
406.603 g·mol−1 |
Heat of Formation |
675.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
9.04 ± 1.08 D |
Volume |
563.54 Å 3 |
Surface Area |
481.41 Å 2 |
HOMO Energy |
-2.58 ± 0.55 eV |
LUMO Energy |
-1.35 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 4-(5-{4-[dimethyl(prop-2-enyl)ammonio]phenyl}-3-oxopentyl)-n,n-dimethyl-n-prop-2-enylbenzenaminium
- [4-[5-[4-(dimethyl-prop-2-enyl-azaniumyl)phenyl]-3-oxo-pentyl]phenyl]-dimethyl-prop-2-enyl-azanium
- allyl-[4-[5-[4-(allyl-dimethyl-ammonio)phenyl]-3-keto-pentyl]phenyl]-dimethyl-ammonium
- allyl-[4-[5-[4-(allyl-dimethyl-ammonio)phenyl]-3-oxo-pentyl]phenyl]-dimethyl-ammonium
- allyl-[4-[5-[4-(allyl-dimethylammonio)phenyl]-3-oxopentyl]phenyl]-dimethylammonium
- ebw
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InChIKey |
ZAEXMNKDGJNLTA-UHFFFAOYSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
H
C
O
N
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