Geometry & MOs

Info

ID:	233948
PubChem CID:	92297407
Reduced:	O4H22C23 (1)
Stoich.:	A4B22C23 (1)
Weight, g/mol:	392.162374
ΔH_f, kcal/mol:	-78.05
Dipole, Da:	1.61
IP(EA), eV:	-8.31(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[6-[(1S)-1-(4-phenylmethoxyphenyl)ethyl]-1,3-benzodioxol-5-yl]oxy]ethanol

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=C(C=C1)OCC2=CC=CC=C2)C3=CC4=C(C=C3OC)OCO4

DOS

IR

Vibrations