Geometry & MOs

Info

ID:	19220
PubChem CID:	558296
Reduced:	O2C8H9 (2)
Stoich.:	A2B8C9 (2)
Weight, g/mol:	274.120509
ΔH_f, kcal/mol:	-145.37
Dipole, Da:	0.47
IP(EA), eV:	-8.67(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(3-methylbut-2-enoyloxy)phenyl] 3-methylbut-2-enoate

Drug info:

PubChemData

Smile

CC(=CC(=O)OC1=CC=C(C=C1)OC(=O)C=C(C)C)C

DOS

IR

Vibrations