Geometry & MOs

Info

ID:

177473

PubChem CID:

76190791

Reduced:

N2O4H26C27 (1)

Stoich.:

A2B4C26D27 (1)

Weight, g/mol:

862.491688

ΔHf, kcal/mol:

-53.99

Dipole, Da:

1.75

IP(EA), eV:

 -7.93(-1.0)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[1-[2-[[6-fluoro-2-[6-fluoro-3-[[1-[3-methoxy-2-[2-(methylamino)propanoylamino]butanoyl]-3-methylpyrrolidin-2-yl]methyl]-1H-indol-2-yl]-1H-indol-3-yl]methyl]-3-methylpyrrolidin-1-yl]-3-methoxy-1-oxobutan-2-yl]-2-(methylamino)propanamide

Drug info:

PubChemData

Smile

CC1C(=COC2C=C(C(=O)O2)C)C(=O)C3=C1C4=C(N3C)C=CC(=C4)C5=CC=C(C=C5)N(C)C

DOS

IR

Vibrations