Geometry & MOs

Info

ID:	146341
PubChem CID:	53672179
Reduced:	OC13H16 (1)
Stoich.:	AB13C16 (1)
Weight, g/mol:	540.272318
ΔH_f, kcal/mol:	-27.0
Dipole, Da:	1.6
IP(EA), eV:	-9.18(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[[4-[3-(2,6-dimethoxy-3-propylphenyl)prop-2-enoyl]phenoxy]-(2,2-dimethylpropanoyloxy)methyl] 2,2-dimethylpropanoate

Drug info:

PubChemData

Smile

C[C@@H]1CC(=C[C@H](O1)C)C2=CC=CC=C2

DOS

IR

Vibrations