Geometry & MOs

Info

ID:	286152
PubChem CID:	104156633
Reduced:	BrON2C13H15 (1)
Stoich.:	ABC2D13E15 (1)
Weight, g/mol:	368.03856
ΔH_f, kcal/mol:	8.38
Dipole, Da:	4.51
IP(EA), eV:	-8.64(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-ethyl-6-(3-iodophenoxy)pyridin-4-yl]-N-methylmethanamine

Drug info:

PubChemData

Smile

COC1CCN(CC1)C2=C(C=C(C=C2)Br)C#N

DOS

IR

Vibrations