Geometry & MOs

Info

ID:

383056

PubChem CID:

134974559

Reduced:

CH (20)

Stoich.:

AB (20)

Weight, g/mol:

728.295848

ΔHf, kcal/mol:

63.34

Dipole, Da:

0.78

IP(EA), eV:

-9.02(0.05)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

[(3R,5S)-5-[[(2S)-3-(1H-indol-3-yl)-1-methoxy-1-oxopropan-2-yl]carbamoyl]-1-pyridin-4-ylpyrrolidin-3-yl] (2S)-3-(1H-indol-2-yl)-2-(phenylmethoxycarbonylamino)propanoate

Drug info:

PubChemData

Smile

C1CC=C(C1)[C@H](/C=C/C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations