Geometry & MOs

Info

ID:	79525
PubChem CID:	49816690
Reduced:	ClO2N3C17H20 (1)
Stoich.:	AB2C3D17E20 (1)
Weight, g/mol:	381.124405
ΔH_f, kcal/mol:	-78.2
Dipole, Da:	2.42
IP(EA), eV:	-9.66(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-chloro-6-methylphenyl)-2-(4-ethyl-6-oxo-2-phenylpyrimidin-1-yl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=O)N(C(=N1)C2=CC(=CC=C2)Cl)CC(=O)NC(C)(C)C

DOS

IR

Vibrations