Geometry & MOs

Info

ID:	378993
PubChem CID:	134228793
Reduced:	OF2N8H14C15 (1)
Stoich.:	AB2C8D14E15 (1)
Weight, g/mol:	483.219829
ΔH_f, kcal/mol:	25.25
Dipole, Da:	4.4
IP(EA), eV:	-8.81(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-dibenzofuran-2-yl-N-[4-[(1Z)-1-[4-methyl-5-[(Z)-prop-1-enyl]-3H-furan-2-ylidene]ethyl]phenyl]aniline

Drug info:

PubChemData

Smile

CN1C(=O)N(N=N1)C2=CC(=C(C=C2C3CC3)F)NC4=NC=C(C(=N4)N)F

DOS

IR

Vibrations