Geometry & MOs

Info

ID:	404609
PubChem CID:	135067686
Reduced:	NOCl3H14C24 (1)
Stoich.:	ABC3D14E24 (1)
Weight, g/mol:	355.154784
ΔH_f, kcal/mol:	47.39
Dipole, Da:	2.77
IP(EA), eV:	-9.6(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-tert-butylphenyl)-6-phenyl-4-(trifluoromethyl)pyridine

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C2=CC(=C(N=C2)C(=O)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl)Cl

DOS

IR

Vibrations