Geometry & MOs

Info

ID:	393808
PubChem CID:	135021723
Reduced:	O2C19H22 (1)
Stoich.:	A2B19C22 (1)
Weight, g/mol:	282.16198
ΔH_f, kcal/mol:	-49.75
Dipole, Da:	3.65
IP(EA), eV:	-8.85(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,4S)-2-benzyl-4-(4-methoxyphenyl)oxane

Drug info:

PubChemData

Smile

COC1=CC=CC=C1[C@H]2CCO[C@H](C2)CC3=CC=CC=C3

DOS

IR

Vibrations