Geometry & MOs

Info

ID:	382666
PubChem CID:	134973954
Reduced:	BrSO3C19H19 (1)
Stoich.:	ABC3D19E19 (1)
Weight, g/mol:	275.131014
ΔH_f, kcal/mol:	-86.65
Dipole, Da:	3.1
IP(EA), eV:	-8.64(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,6-dimethyl-3,5-diphenyl-1H-pyridin-2-one

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1C)Br)OCC2=CCSC3=C2C(=O)OC(=C3)C)C

DOS

IR

Vibrations