Geometry & MOs

Info

ID:	386014
PubChem CID:	134980536
Reduced:	OH12C14 (2)
Stoich.:	AB12C14 (2)
Weight, g/mol:	280.14633
ΔH_f, kcal/mol:	35.36
Dipole, Da:	3.07
IP(EA), eV:	-8.7(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3S)-2-hydroxy-1-phenyl-3-(2-phenylethyl)pent-4-en-1-one

Drug info:

PubChemData

Smile

C=C[C@H](C1=CC2=CC=CC=C2C=C1)[C@H](C(=O)C3=CC=CC=C3)OCC4=CC=CC=C4

DOS

IR

Vibrations