Geometry & MOs

Info

ID:

214530

PubChem CID:

85083158

Reduced:

ClNOC15H27 (2)

Stoich.:

ABCD15E27 (2)

Weight, g/mol:

545.321334

ΔHf, kcal/mol:

-169.08

Dipole, Da:

4.51

IP(EA), eV:

 -9.42(1.1)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

tert-butyl N-[1-[[1-[[1-(hydroxyamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C(CCCCCCC=CCC=CCC=CCC=CCC=CCC=CCC(C(C)N)O)O)N.Cl.Cl

DOS

IR

Vibrations