Geometry & MOs
Info
ID: |
436753 |
PubChem CID: |
135210573 |
Reduced: |
NOC21H33 (1) |
Stoich.: |
ABC21D33 (1) |
Weight, g/mol: |
1379.560655 |
ΔHf, kcal/mol: |
-71.0 |
Dipole, Da: |
4.31 |
IP(EA), eV: |
-8.96(0.42) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
[(19S)-19-ethyl-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaen-19-yl] 2-[[2-[[4-(2-amino-2,4,4-trimethyl-3-oxopentoxy)-4-methylpentanoyl]amino]-3-[2-[2-(tert-butylamino)-3-[[2-[[(19S)-19-ethyl-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,15(20)-heptaen-19-yl]oxy]-2-oxoethyl]amino]-3-oxopropyl]sulfanylcyclobutyl]sulfanylpropanoyl]amino]acetate