Geometry & MOs

Info

ID:	442491
PubChem CID:	135252436
Reduced:	N2O2F3H11C18 (1)
Stoich.:	A2B2C3D11E18 (1)
Weight, g/mol:	350.126657
ΔH_f, kcal/mol:	-139.82
Dipole, Da:	3.11
IP(EA), eV:	-9.73(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6-pyridin-2-ylpyridin-2-yl)-(3,4,5-trimethoxyphenyl)methanone

Drug info:

PubChemData

Smile

C1=CC=NC(=C1)C2=NC(=CC=C2)C(=O)C3=CC=C(C=C3)OC(F)(F)F

DOS

IR

Vibrations