Geometry & MOs

Info

ID:	386632
PubChem CID:	134982407
Reduced:	NO7C27H39 (1)
Stoich.:	AB7C27D39 (1)
Weight, g/mol:	440.144616
ΔH_f, kcal/mol:	-288.11
Dipole, Da:	4.1
IP(EA), eV:	-8.12(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(benzenesulfinyl)-1,2-diphenylpropan-2-yl] benzoate

Drug info:

PubChemData

Smile

C[C@H]1[C@H](O[C@](CC1=C)([C@@H](C(=O)N2[C@H](CCC2=O)C(C)C)OCC3=CC(=C(C=C3)OC)OC)OC)C

DOS

IR

Vibrations