Geometry & MOs
Info
ID: |
435113 |
PubChem CID: |
135180893 |
Reduced: |
N3O4H13C15 (1) |
Stoich.: |
A3B4C13D15 (1) |
Weight, g/mol: |
1204.343647 |
ΔHf, kcal/mol: |
-108.16 |
Dipole, Da: |
1.96 |
IP(EA), eV: |
-9.05(-1.47) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
N-[(3R,4S)-4-[[6-[2,6-dichloro-3-[2-[4-[6-(2,6-dichloro-3,5-dimethoxyphenyl)-2-[[(3S,4R)-4-(prop-2-enoylamino)oxolan-3-yl]amino]pyrido[3,4-d]pyrimidin-8-yl]-6-methylmorpholin-2-yl]ethoxy]-5-methoxyphenyl]-8-(4-methoxypiperidin-1-yl)pyrido[3,4-d]pyrimidin-2-yl]amino]oxolan-3-yl]prop-2-enamide