Geometry & MOs

Info

ID:

181308

PubChem CID:

76729545

Reduced:

NOSiC18H25 (1)

Stoich.:

ABCD18E25 (1)

Weight, g/mol:

659.301387

ΔHf, kcal/mol:

-6.81

Dipole, Da:

1.74

IP(EA), eV:

 -8.73(0.34)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[2-[carboxymethyl-[2-[2-[(5,6-diacetyloxy-3,4-dimethyloxan-2-yl)methylamino]ethylamino]-2-oxoethyl]amino]ethyl-[2-(2,6-dioxomorpholin-4-yl)ethyl]amino]acetic acid

Drug info:

PubChemData

Smile

C[Si](C)(C)C#CC(C=CC1=CC=CC=C1)N2CCOCC2

DOS

IR

Vibrations