Geometry & MOs

Info

ID:	67064
PubChem CID:	46505795
Reduced:	OC25H28 (1)
Stoich.:	AB25C28 (1)
Weight, g/mol:	324.172545
ΔH_f, kcal/mol:	6.82
Dipole, Da:	3.71
IP(EA), eV:	-9.54(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2E,6E)-2,6-bis(furan-2-ylmethylidene)-4-(2-methylbutan-2-yl)cyclohexan-1-one

Drug info:

PubChemData

Smile

CCC(C1C/C(=C\C2=CC=CC=C2)/C(=O)/C(=C/C3=CC=CC=C3)/C1)(C)C

DOS

IR

Vibrations