Geometry & MOs

Info

ID:	43237
PubChem CID:	10320036
Reduced:	N2O4F6H12C17 (1)
Stoich.:	A2B4C6D12E17 (1)
Weight, g/mol:	422.068983
ΔH_f, kcal/mol:	-362.54
Dipole, Da:	10.3
IP(EA), eV:	-10.21(-1.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(difluoromethoxy)-N-pyridin-4-yl-8-(trifluoromethyl)dibenzofuran-1-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC(C(=O)NC2=CC(=C(C=C2)[N+](=O)[O-])C(F)(F)F)(C(F)(F)F)O

DOS

IR

Vibrations