| Formula |
C27H32N6O4S |
| IUPAC Name |
[azaniumylidene-[7-[[n-(carboxymethylsulfonyl)-4-[(1r)-4-ethanimidoyl-1,4-diazepan-1-yl]anilino]methyl]-2-naphthyl]methyl]azanide |
| Molecular Mass |
536.646 g·mol−1 |
| Heat of Formation |
3758.1 ± 16.7 kJ·mol−1 |
| Dipole Moment |
37.01 ± 1.08 D |
| Volume |
477.7 Å 3 |
| Surface Area |
413.07 Å 2 |
| HOMO Energy |
-7.78 ± 0.55 eV |
| LUMO Energy |
-4.42 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
XYDKLCGZUGKCJO-TURZUDJPSA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
H
S
C
O
N
|
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