Geometry & MOs

Info

ID:

397532

PubChem CID:

135030350

Reduced:

O2H19C25 (2)

Stoich.:

A2B19C25 (2)

Weight, g/mol:

231.12907

ΔHf, kcal/mol:

183.18

Dipole, Da:

4.05

IP(EA), eV:

-8.59(-1.15)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N,N,2-trimethyl-3-oxo-2-trimethylsilyloxybutanamide

Drug info:

PubChemData

Smile

CC(=O)O[C@H](CC#C)C1=CC(=C(C=C1C#CC2=C(C=CC3=CC=CC=C32)CCC#C)C#CC4=C(C=CC5=CC=CC=C54)CCC#C)[C@@H](CC#C)OC(=O)C

DOS

IR

Vibrations