Geometry & MOs

Info

ID:

309899

PubChem CID:

126566162

Reduced:

FN5H28C34 (1)

Stoich.:

AB5C28D34 (1)

Weight, g/mol:

459.263425

ΔHf, kcal/mol:

172.13

Dipole, Da:

7.82

IP(EA), eV:

 -8.64(-1.97)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-amino-N-[(2R)-3-(1H-indol-3-yl)-1-[[(2S)-1-(1H-indol-3-yl)butan-2-yl]amino]-1-oxopropan-2-yl]-2-methylpropanamide

Drug info:

PubChemData

Smile

C/C(=C\C=C\1/C(=C)/C(=C/2\C=C3C(=CN=CC3=N2)C4=CC(=CC=C4)F)/NN1)/C5=CN=CC(=C5)CCC6=CC=CC=C6

DOS

IR

Vibrations