Geometry & MOs

Info

ID:	46772
PubChem CID:	10527174
Reduced:	SN2O6C22H22 (1)
Stoich.:	AB2C6D22E22 (1)
Weight, g/mol:	442.174436
ΔH_f, kcal/mol:	-189.43
Dipole, Da:	10.33
IP(EA), eV:	-8.67(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-(2,4-difluorophenyl)-2-methyl-3-trityloxypropan-1-one

Drug info:

PubChemData

Smile

CC(C)C1=C2C(=CC(=C1)OC)S(=O)(=O)N(C2=O)COC3=CC(=O)N(C4=CC=CC=C43)C

DOS

IR

Vibrations