Geometry & MOs

Info

ID:	401839
PubChem CID:	135052873
Reduced:	O2H8C9 (2)
Stoich.:	A2B8C9 (2)
Weight, g/mol:	306.125594
ΔH_f, kcal/mol:	-83.78
Dipole, Da:	5.64
IP(EA), eV:	-8.69(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2Z)-2-benzylidene-7,7-dimethyl-5,6-dihydrofuro[3,2-g]chromen-3-one

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1OC)O/C(=C\C3=CC(=CC=C3)OC)/C2=O

DOS

IR

Vibrations