Geometry & MOs

Info

ID:

320749

PubChem CID:

126663170

Reduced:

NO11C28H55 (1)

Stoich.:

AB11C28D55 (1)

Weight, g/mol:

760.509863

ΔHf, kcal/mol:

-588.75

Dipole, Da:

1.12

IP(EA), eV:

 -9.91(0.2)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-(dimethylamino)-N-[2-[[1-[2-[3-[[1-(3-hydroxypropylamino)-1-oxo-3-phenylpropan-2-yl]amino]-1-methoxy-2-methyl-3-oxopropyl]pyrrolidin-1-yl]-3-methoxy-5-methyl-1-oxoheptan-4-yl]-methylamino]-2-oxoethyl]-3-methylbutanamide

Drug info:

PubChemData

Smile

CC(C)OC(COC(=O)NCCC(=O)O)OC(CC(C)(C)CC(C)(C)OC(CO)OC(CC(C)(C)C)CO)CO

DOS

IR

Vibrations