Geometry & MOs

Info

ID:	442696
PubChem CID:	135255828
Reduced:	O5C17H19 (2)
Stoich.:	A5B17C19 (2)
Weight, g/mol:	402.11371
ΔH_f, kcal/mol:	-387.4
Dipole, Da:	0.66
IP(EA), eV:	-8.72(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[4-[2-(2,2-dioxo-1,3,2-dioxathian-5-yl)ethyl]phenyl]phenyl] 2-methylprop-2-enoate

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)OC(=O)C2=CC=C(C=C2)OCCCOC(=O)C(C)(C)C)OC(=O)C3=CC=C(C=C3)OCCCOC(=O)C

DOS

IR

Vibrations