N-Butyl-3-{[6-(3H-Purin-6-Ylamino)Hexanoyl]Amino}Benzamide
Properties
Property | Value |
---|---|
Formula | C22H29N7O2 |
IUPAC Name | n-butyl-3-[6-(purin-9-ium-1-id-6-ylamino)hexanoylamino]benzamide |
Molecular Mass | 423.511 g·mol−1 |
Heat of Formation | -128.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.50 ± 1.08 D |
Volume | 521.42 Å 3 |
Surface Area | 486.65 Å 2 |
HOMO Energy | -8.80 ± 0.55 eV |
LUMO Energy | 2.59 ± eV |
Point Group Symmetry | C1 |
InChIKey | WOYITRCGMUXUDE-UHFFFAOYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
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Elements | H C O N |