Geometry & MOs

Info

ID:	334153
PubChem CID:	127252705
Reduced:	N2O2C21H22 (1)
Stoich.:	A2B2C21D22 (1)
Weight, g/mol:	516.142032
ΔH_f, kcal/mol:	-32.36
Dipole, Da:	4.89
IP(EA), eV:	-8.28(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[2-[(2Z)-2-[(3,4-dimethoxyphenyl)methylidene]-3,7-dioxo-8,9-dihydrofuro[2,3-f]chromen-9-yl]phenoxy]acetate

Drug info:

PubChemData

Smile

CN1C=C(C2=CC=CC=C21)CCNC(=O)CC3=CC4=C(C=C3)OCC4

DOS

IR

Vibrations