Geometry & MOs

Info

ID:	125841
PubChem CID:	50941148
Reduced:	SSiO3C14H22 (1)
Stoich.:	ABC3D14E22 (1)
Weight, g/mol:	316.086622
ΔH_f, kcal/mol:	-156.92
Dipole, Da:	2.96
IP(EA), eV:	-8.77(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (3S,4R)-4-(4-chlorophenyl)-4-hydroxy-2-methylidene-3-phenylbutanoate

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OC(C1=CC=CS1)C(=C)C(=O)O

DOS

IR

Vibrations