Geometry & MOs

Info

ID:	122318
PubChem CID:	50802164
Reduced:	N3O4H23C25 (1)
Stoich.:	A3B4C23D25 (1)
Weight, g/mol:	433.143784
ΔH_f, kcal/mol:	-76.82
Dipole, Da:	6.15
IP(EA), eV:	-8.44(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-fluorophenoxy)-N-[3-[(9-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]acetamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)C)OCC3=CC(=O)N4C=CC=CC4=N3

DOS

IR

Vibrations