Geometry & MOs

Info

ID:

220673

PubChem CID:

85202065

Reduced:

SiO6C34H44 (1)

Stoich.:

AB6C34D44 (1)

Weight, g/mol:

578.358054

ΔHf, kcal/mol:

-236.31

Dipole, Da:

3.09

IP(EA), eV:

 -8.09(-0.34)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

ethyl 2-[1-[[2-(azepane-1-carbonylamino)-4-methylpentanoyl]amino]-2-(1H-indol-3-yl)ethyl]-5-propyl-1H-imidazole-4-carboxylate

Drug info:

PubChemData

Smile

CC(CO[Si](C1=CC=CC=C1)(C2=CC=CC=C2)C(C)(C)C)C(CC=CC(=O)OC)OCC3=CC(=C(C=C3)OC)OC

DOS

IR

Vibrations