Geometry & MOs

Info

ID:	447361
PubChem CID:	135282265
Reduced:	F2O3N4C18H22 (1)
Stoich.:	A2B3C4D18E22 (1)
Weight, g/mol:	229.06514
ΔH_f, kcal/mol:	-183.62
Dipole, Da:	8.44
IP(EA), eV:	-9.57(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-6-methoxy-5-pyridin-4-ylpyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC(C)CC(C)(COC1=C(C=C(C(=C1)F)C2=NC(=NC=C2)NC(=O)O)F)N

DOS

IR

Vibrations