Geometry & MOs

Info

ID:	218981
PubChem CID:	85090289
Reduced:	OSC20H24 (1)
Stoich.:	ABC20D24 (1)
Weight, g/mol:	300.118401
ΔH_f, kcal/mol:	-18.83
Dipole, Da:	2.68
IP(EA), eV:	-8.56(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3S)-3-(4-methoxyphenyl)sulfanyl-2-phenyloxane

Drug info:

PubChemData

Smile

CC(C)C1=CC=CC=C1S[C@H]2CCCO[C@@H]2C3=CC=CC=C3

DOS

IR

Vibrations