Geometry & MOs

Info

ID:	382630
PubChem CID:	134973902
Reduced:	OC4H4 (7)
Stoich.:	AB4C4 (7)
Weight, g/mol:	324.120903
ΔH_f, kcal/mol:	-199.23
Dipole, Da:	3.14
IP(EA), eV:	-8.63(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (E)-3-[(8S,13S)-9-methoxy-11-oxo-1,4,12-trioxadispiro[4.2.48.25]tetradec-9-en-13-yl]prop-2-enoate

Drug info:

PubChemData

Smile

CO[C@@]1(C(=O)[C@H](OC1=O)[C@H](COCC2=CC=CC=C2)O)CC3=CC=C(C=C3)OCC4=CC=CC=C4

DOS

IR

Vibrations