Geometry & MOs

Info

ID:	343884
PubChem CID:	127267060
Reduced:	FON5C18H20 (1)
Stoich.:	ABC5D18E20 (1)
Weight, g/mol:	303.119461
ΔH_f, kcal/mol:	18.43
Dipole, Da:	6.58
IP(EA), eV:	-8.81(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-2-[2-methyl-6-oxo-4-(trifluoromethyl)pyrimidin-1-yl]acetamide

Drug info:

PubChemData

Smile

C1COCCN1CC2=NC=CN2CC3=NN(C=C3)C4=CC=CC=C4F

DOS

IR

Vibrations