Geometry & MOs

Info

ID:	147833
PubChem CID:	53787491
Reduced:	SN2O3C26H26 (1)
Stoich.:	AB2C3D26E26 (1)
Weight, g/mol:	288.091707
ΔH_f, kcal/mol:	-56.54
Dipole, Da:	5.11
IP(EA), eV:	-8.44(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-chlorophenoxy)-2,2-dimethyl-1-phenylpropan-1-one

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C(=O)N3CC(C4=CC=CC=C43)C5=CC=CC=C5

DOS

IR

Vibrations