Geometry & MOs

Info

ID:

224106

PubChem CID:

85338218

Reduced:

O15C28H32 (1)

Stoich.:

A15B28C32 (1)

Weight, g/mol:

614.269355

ΔHf, kcal/mol:

-582.47

Dipole, Da:

9.42

IP(EA), eV:

 -9.34(-1.08)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[(2-amino-2-methylpropanoyl)amino]-N-[[3-(4-chlorophenyl)-2,2-dioxo-2lambda6-thia-1-azaspiro[4.5]dec-3-en-4-yl]methyl]-N-ethyl-5-phenylpentanamide

Drug info:

PubChemData

Smile

CC1C(C(C(C(O1)OC2C(OC(C(C2O)O)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)OC)CO)O)O)O

DOS

IR

Vibrations