Geometry & MOs

Info

ID:	136371
PubChem CID:	52030438
Reduced:	FO2N3H20C25 (1)
Stoich.:	AB2C3D20E25 (1)
Weight, g/mol:	413.153955
ΔH_f, kcal/mol:	-32.55
Dipole, Da:	2.54
IP(EA), eV:	-9.11(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-fluorophenyl)-3-(6-oxo-2,4-diphenylpyrimidin-1-yl)propanamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=O)N(C(=N2)C3=CC=CC=C3)CCC(=O)NC4=CC=CC=C4F

DOS

IR

Vibrations