Geometry & MOs

Info

ID:	28297
PubChem CID:	826882
Reduced:	ON3C21H27 (1)
Stoich.:	AB3C21D27 (1)
Weight, g/mol:	290.094294
ΔH_f, kcal/mol:	-10.41
Dipole, Da:	3.94
IP(EA), eV:	-9.11(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1-benzofuran-2-yl)-6,8-dimethylchromen-2-one

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1C)N=C3C(=N2)[C@@]4(CC[C@]3(C4(C)C)C(=O)N(C)C)C

DOS

IR

Vibrations