Geometry & MOs

Info

ID:	411414
PubChem CID:	135084237
Reduced:	OC13H24 (1)
Stoich.:	AB13C24 (1)
Weight, g/mol:	208.109944
ΔH_f, kcal/mol:	-47.24
Dipole, Da:	1.5
IP(EA), eV:	-9.64(1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,5-dimethoxyphenyl)but-3-en-2-ol

Drug info:

PubChemData

Smile

CCCC[C@]1([C@@H]([C@@H]1COC)CC=C)C

DOS

IR

Vibrations