Geometry & MOs

Info

ID:	402293
PubChem CID:	135055365
Reduced:	O2C8H11 (2)
Stoich.:	A2B8C11 (2)
Weight, g/mol:	278.151809
ΔH_f, kcal/mol:	-153.55
Dipole, Da:	1.55
IP(EA), eV:	-9.4(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (E)-2-hydroxy-4-methyl-6-phenylmethoxyhex-4-enoate

Drug info:

PubChemData

Smile

CCOC(=O)C(CC(=C)CCOCC1=CC=CC=C1)O

DOS

IR

Vibrations