Geometry & MOs

Info

ID:	79518
PubChem CID:	49816669
Reduced:	ClO2N3H16C19 (1)
Stoich.:	AB2C3D16E19 (1)
Weight, g/mol:	413.114234
ΔH_f, kcal/mol:	-24.77
Dipole, Da:	1.33
IP(EA), eV:	-9.0(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(3-chlorophenyl)-4-methyl-6-oxopyrimidin-1-yl]-N-(3,5-dimethoxyphenyl)acetamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations