Geometry & MOs

Info

ID:	51564
PubChem CID:	12014256
Reduced:	O2C15H20 (1)
Stoich.:	A2B15C20 (1)
Weight, g/mol:	204.11503
ΔH_f, kcal/mol:	-59.67
Dipole, Da:	2.18
IP(EA), eV:	-9.41(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R,4S)-4-phenylmethoxyhexa-1,5-dien-3-ol

Drug info:

PubChemData

Smile

C/1C[C@H]([C@H](CC/C=C1)OCC2=CC=CC=C2)O

DOS

IR

Vibrations