Geometry & MOs

Info

ID:	425721
PubChem CID:	135127606
Reduced:	NO2C12H15 (2)
Stoich.:	AB2C12D15 (2)
Weight, g/mol:	260.120115
ΔH_f, kcal/mol:	-149.58
Dipole, Da:	4.43
IP(EA), eV:	-8.52(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3E,5Z)-hepta-1,3,5-trien-3-yl]dibenzofuran

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)C(C3=CC=CC=C32)COC(=O)NCCCC[C@@H](C(=O)O)N(C)C

DOS

IR

Vibrations