2-(Dimethylamino)-3,7-Dihydropurine-1,9-Diium-5-Id-6-One
Properties
Property | Value |
---|---|
Formula | C7H16N5O+ |
IUPAC Name | (2s,4r,5s)-2-(dimethylamino)-1,2,3,4,5,7,8,9-octahydropurin-3-ium-6-one |
Molecular Mass | 186.235 g·mol−1 |
Heat of Formation | 99.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.52 ± 1.08 D |
Volume | 202.15 Å 3 |
Surface Area | 199.81 Å 2 |
HOMO Energy | -9.16 ± 0.55 eV |
LUMO Energy | -0.68 ± eV |
Point Group Symmetry | C1 |
InChIKey | DDPRHXILCVNLSO-UHFFFAOYSA-O |
QR Code | Generate QR Code |
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Elements | H C O N |