Geometry & MOs

Info

ID:	45923
PubChem CID:	10519211
Reduced:	O2C21H28 (1)
Stoich.:	A2B21C28 (1)
Weight, g/mol:	312.155699
ΔH_f, kcal/mol:	-96.03
Dipole, Da:	3.54
IP(EA), eV:	-8.3(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[tert-butyl(dimethyl)silyl]oxy-2-fluoro-2-phenylpropanoate

Drug info:

PubChemData

Smile

CC1=C2CCC[C@@](C2=CC3=CC(=C(C=C13)OC)C(C)C)(C)CO

DOS

IR

Vibrations