Geometry & MOs

Info

ID:	324803
PubChem CID:	126678375
Reduced:	BrNO4C14H14 (1)
Stoich.:	ABC4D14E14 (1)
Weight, g/mol:	273.078979
ΔH_f, kcal/mol:	-158.67
Dipole, Da:	4.53
IP(EA), eV:	-9.88(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-nitrosophenyl)dibenzofuran

Drug info:

PubChemData

Smile

CCOC(=O)[C@H]1[C@@H](CC(=O)NC1=O)C2=CC=C(C=C2)Br

DOS

IR

Vibrations