Geometry & MOs

Info

ID:	83562
PubChem CID:	49857904
Reduced:	NO2H11C13 (2)
Stoich.:	AB2C11D13 (2)
Weight, g/mol:	344.116092
ΔH_f, kcal/mol:	-27.82
Dipole, Da:	1.2
IP(EA), eV:	-8.73(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-[3-(2-oxo-2-pyridin-2-ylacetyl)phenyl]benzamide

Drug info:

PubChemData

Smile

C[C@@H](C#CC1=CC=C(C=C1)OC2=CN=C(C=C2)OC(C)C)N3C(=O)C4=CC=CC=C4C3=O

DOS

IR

Vibrations