Geometry & MOs

Info

ID:

445527

PubChem CID:

135267626

Reduced:

FN4O5H35C37 (1)

Stoich.:

AB4C5D35E37 (1)

Weight, g/mol:

589.258814

ΔHf, kcal/mol:

-124.49

Dipole, Da:

3.78

IP(EA), eV:

 -8.11(-1.14)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methyl 2-[5-[3-(tert-butylcarbamoyl)cyclohexa-1,5-dien-1-yl]-2-[(1R)-4-fluorocyclohexa-2,4-dien-1-yl]-2-methyl-3-(methylcarbamoyl)-3,6-dihydrofuro[2,3-e]indol-8-yl]-2-oxoacetate

Drug info:

PubChemData

Smile

CC(C)(C)NC(=O)C1=CC=CC(=C1)C2=C3C(=C4C(C2)C(=C(O4)C5=CC=C(C=C5)F)C(=O)NC)C(=CN3)C(=O)C(=O)NC6CC=CC=C6

DOS

IR

Vibrations