Geometry & MOs

Info

ID:	146179
PubChem CID:	53648655
Reduced:	O8C25H44 (1)
Stoich.:	A8B25C44 (1)
Weight, g/mol:	226.09938
ΔH_f, kcal/mol:	-442.33
Dipole, Da:	5.1
IP(EA), eV:	-10.66(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-phenoxyprop-1-enoxybenzene

Drug info:

PubChemData

Smile

CCCCC(C)(C)C(CCCC(CCCCCCC(=O)OCC)(C(=O)O)C(=O)O)OC(=O)C

DOS

IR

Vibrations