Geometry & MOs

Info

ID:	47909
PubChem CID:	10535808
Reduced:	O3C11H14 (1)
Stoich.:	A3B11C14 (1)
Weight, g/mol:	194.094294
ΔH_f, kcal/mol:	-127.44
Dipole, Da:	1.85
IP(EA), eV:	-8.47(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,3R)-3-hydroperoxy-1-phenylpent-4-en-1-ol

Drug info:

PubChemData

Smile

CC1(C(CC2=C(O1)C=CC(=C2)O)O)C

DOS

IR

Vibrations