Geometry & MOs

Info

ID:	46045
PubChem CID:	10520703
Reduced:	O4H18C21 (1)
Stoich.:	A4B18C21 (1)
Weight, g/mol:	334.120509
ΔH_f, kcal/mol:	-83.14
Dipole, Da:	8.29
IP(EA), eV:	-9.08(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S,3R)-3-[(1R,2S)-1,2-dihydroxy-2-phenylethyl]oxiran-2-yl]-naphthalen-2-ylmethanone

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC2=CC=CC(=C2OCC3=CC=CC=C3)C(=O)O

DOS

IR

Vibrations