Geometry & MOs

Info

ID:	44582
PubChem CID:	10504199
Reduced:	NO5F6H13C20 (1)
Stoich.:	AB5C6D13E20 (1)
Weight, g/mol:	460.10693
ΔH_f, kcal/mol:	-470.78
Dipole, Da:	6.5
IP(EA), eV:	-10.36(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (E)-2-bromo-4-[tert-butyl(diphenyl)silyl]oxy-3-methylbut-2-enoate

Drug info:

PubChemData

Smile

CCOC(=O)C1(C2=CC=CC=C2C(=O)N(C1=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)O

DOS

IR

Vibrations