3-(12-Methoxy-15-Nitro-20-Aza-21,22-Diazoniatetracyclo[Blah.Blah.Blah.Blah.Blah]Hexadeca-4,6,8(12),13(20),14(17),15(18),16(19),21-Octaen-22-Yl)-N,N-Dimethyl-Propan-1-Amine
Properties
Property | Value |
---|---|
Formula | C19H21N5O3 |
IUPAC Name | 3-(12-methoxy-15-nitro-20-aza-21,22-diazoniatetracyclo[blah.blah.blah.blah.blah]hexadeca-4,6,8(12),13(20),14(17),15(18),16(19),21-octaen-22-yl)-n,n-dimethyl-propan-1-amine |
Molecular Mass | 367.402 g·mol−1 |
Heat of Formation | 255.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 11.31 ± 1.08 D |
Volume | 431.92 Å 3 |
Surface Area | 366.23 Å 2 |
HOMO Energy | -8.27 ± 0.55 eV |
LUMO Energy | 1.41 ± eV |
Point Group Symmetry | C1 |
InChIKey | DSIJPHVUBDFDRA-UHFFFAOYSA-N |
QR Code | Generate QR Code |
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Elements | H C O N |