Geometry & MOs

Info

ID:	79522
PubChem CID:	49816685
Reduced:	ClN3O4H18C21 (1)
Stoich.:	AB3C4D18E21 (1)
Weight, g/mol:	381.124405
ΔH_f, kcal/mol:	-112.11
Dipole, Da:	5.83
IP(EA), eV:	-9.31(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(3-chlorophenyl)-4-methyl-6-oxopyrimidin-1-yl]-N-(2,3-dimethylphenyl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=O)N(C(=N1)C2=CC(=CC=C2)Cl)CC(=O)NC3=CC=C(C=C3)C(=O)OC

DOS

IR

Vibrations