Geometry & MOs

Info

ID:

314048

PubChem CID:

126620093

Reduced:

NO2C11H23 (1)

Stoich.:

AB2C11D23 (1)

Weight, g/mol:

751.382614

ΔHf, kcal/mol:

-98.78

Dipole, Da:

1.81

IP(EA), eV:

-9.48(0.78)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(2S,4R)-1-[(2S)-2-[[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]acetyl]amino]-3,3-dimethylbutanoyl]-4-hydroxy-N-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)COC/C=C\COCCN

DOS

IR

Vibrations