Geometry & MOs

Info

ID:	371855
PubChem CID:	131275772
Reduced:	O2N4C9H16 (1)
Stoich.:	A2B4C9D16 (1)
Weight, g/mol:	303.92259
ΔH_f, kcal/mol:	-48.24
Dipole, Da:	2.54
IP(EA), eV:	-9.55(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-2-(chloromethyl)-5-(trifluoromethoxy)pyridin-3-amine

Drug info:

PubChemData

Smile

C1CNCCC1(CN2C=C(N=N2)CO)O

DOS

IR

Vibrations