Geometry & MOs

Info

ID:	397086
PubChem CID:	135029707
Reduced:	O3H18C19 (1)
Stoich.:	A3B18C19 (1)
Weight, g/mol:	221.084064
ΔH_f, kcal/mol:	-69.93
Dipole, Da:	1.77
IP(EA), eV:	-9.4(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,8-dimethyldibenzofuran-2-carbonitrile

Drug info:

PubChemData

Smile

CC1(C(=O)C2=CC=CC=C2OC1(/C=C/C3=CC=CC=C3)O)C

DOS

IR

Vibrations