Geometry & MOs

Info

ID:	322573
PubChem CID:	126670553
Reduced:	OF3N3C12H20 (1)
Stoich.:	AB3C3D12E20 (1)
Weight, g/mol:	352.05751
ΔH_f, kcal/mol:	-221.82
Dipole, Da:	4.0
IP(EA), eV:	-9.57(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-bromophenyl)-3-methyl-N-(2-methylphenyl)pyridin-2-amine

Drug info:

PubChemData

Smile

C[C@@H]1C[C@H](NC1)C(=O)NC2CCN(C2)CC(F)(F)F

DOS

IR

Vibrations