Geometry & MOs

Info

ID:	169108
PubChem CID:	75065700
Reduced:	NO5H19C21 (1)
Stoich.:	AB5C19D21 (1)
Weight, g/mol:	320.141245
ΔH_f, kcal/mol:	-32.08
Dipole, Da:	2.6
IP(EA), eV:	-9.28(-1.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,6-dimethylphenyl)-1,5-bis(furan-2-yl)pent-1-en-3-one

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)C(CC2=CC=CO2)C(=O)C=CC3=CC=C(O3)[N+](=O)[O-]

DOS

IR

Vibrations