Geometry & MOs

Info

ID:	11234
PubChem CID:	112193
Reduced:	O6C29H36 (1)
Stoich.:	A6B29C36 (1)
Weight, g/mol:	480.251189
ΔH_f, kcal/mol:	-210.05
Dipole, Da:	1.08
IP(EA), eV:	-8.66(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-methyl-4-[2-[3-methyl-4-(2-prop-2-enoyloxypropoxy)phenyl]propan-2-yl]phenoxy]propan-2-yl prop-2-enoate

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(C)(C)C2=CC(=C(C=C2)OCC(C)OC(=O)C=C)C)OCC(C)OC(=O)C=C

DOS

IR

Vibrations