4-[9-[4-(Diethylamino)Phenyl]-7,7-Dioxido-4-Sulfo-Blahbicyclo[4.3.0]Nona-1(6),2,4-Trien-9-Yl]-N,N-Diethyl-Aniline

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Properties Simple | Detailed

Formula C27H36N2O6S2
IUPAC Name 4-[9-[4-(diethylamino)phenyl]-7,7-dioxido-4-sulfo-blahbicyclo[4.3.0]nona-1(6),2,4-trien-9-yl]-n,n-diethyl-aniline
Molecular Mass 548.715 g·mol−1
Heat of Formation -813.0 ± 16.7 kJ·mol−1
Dipole Moment 8.01 ± 1.08 D
Volume 615.88 Å 3
Surface Area 509.12 Å 2
HOMO Energy -8.17 ± 0.55 eV
LUMO Energy -1.42 ± eV
Point Group Symmetry C1
InChIKey KCHIRUMOZUUSGO-UHFFFAOYSA-N
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