Geometry & MOs

Info

ID:	371992
PubChem CID:	131284569
Reduced:	ClNOC12H14 (1)
Stoich.:	ABCD12E14 (1)
Weight, g/mol:	287.95214
ΔH_f, kcal/mol:	-26.0
Dipole, Da:	4.99
IP(EA), eV:	-9.06(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(bromomethyl)-2-fluoro-5-(trifluoromethoxy)pyridin-3-amine

Drug info:

PubChemData

Smile

CC(C)C1=CC(=C(C(=C1)Cl)O)C(C)C#N

DOS

IR

Vibrations