Geometry & MOs

Info

ID:	81794
PubChem CID:	49855167
Reduced:	ClO3N4C16H17 (1)
Stoich.:	AB3C4D16E17 (1)
Weight, g/mol:	350.119047
ΔH_f, kcal/mol:	-78.38
Dipole, Da:	5.92
IP(EA), eV:	-9.39(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,4-difluorophenyl)-2-(6-morpholin-4-yl-4-oxo-1H-pyrimidin-2-yl)acetamide

Drug info:

PubChemData

Smile

C1COCCN1C2=CC(=O)N=C(N2)CC(=O)NC3=CC(=CC=C3)Cl

DOS

IR

Vibrations