Geometry & MOs

Info

ID:	390802
PubChem CID:	135001016
Reduced:	O3H22C29 (1)
Stoich.:	A3B22C29 (1)
Weight, g/mol:	328.182715
ΔH_f, kcal/mol:	-10.14
Dipole, Da:	2.05
IP(EA), eV:	-8.59(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E,1R,2S)-1-(4-methylphenyl)-2,5-diphenylpent-4-en-1-ol

Drug info:

PubChemData

Smile

C[C@](C1OC2=C(C3=CC=CC=C3C=C2)C4=C(O1)C=CC5=CC=CC=C54)(C6=CC=CC=C6)O

DOS

IR

Vibrations