Geometry & MOs

Info

ID:	405169
PubChem CID:	135072903
Reduced:	OH12C13 (1)
Stoich.:	AB12C13 (1)
Weight, g/mol:	386.124212
ΔH_f, kcal/mol:	41.74
Dipole, Da:	4.35
IP(EA), eV:	-9.3(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(4-methoxyphenyl)-6-(trifluoromethyl)phenyl]methyl]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

C/C=C/C(=O)C#CC1=CC=C(C=C1)C

DOS

IR

Vibrations