Geometry & MOs

Info

ID:	393882
PubChem CID:	135021903
Reduced:	OC19H22 (1)
Stoich.:	AB19C22 (1)
Weight, g/mol:	314.143743
ΔH_f, kcal/mol:	-15.52
Dipole, Da:	1.41
IP(EA), eV:	-9.25(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,4R,6R)-2-(4-chlorophenyl)-4-phenyl-6-propan-2-yloxane

Drug info:

PubChemData

Smile

CC([C@H]1C[C@H](CCO1)C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations