Geometry & MOs

Info

ID:	25391
PubChem CID:	624012
Reduced:	NSiO2F3C11H14 (1)
Stoich.:	ABC2D3E11F14 (1)
Weight, g/mol:	489.88343
ΔH_f, kcal/mol:	-272.69
Dipole, Da:	4.45
IP(EA), eV:	-8.98(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,4-dinitrophenyl) 3-(3,5-dibromo-4-hydroxyphenyl)propanoate

Drug info:

PubChemData

Smile

C[Si](C)(C)OC1=CC=C(C=C1)NC(=O)C(F)(F)F

DOS

IR

Vibrations