Geometry & MOs

Info

ID:	184584
PubChem CID:	77179361
Reduced:	FO3N8C24H31 (1)
Stoich.:	AB3C8D24E31 (1)
Weight, g/mol:	471.171811
ΔH_f, kcal/mol:	-44.94
Dipole, Da:	3.82
IP(EA), eV:	-8.57(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-[4-[ethenyl-[2-methoxy-3-(1,2-oxazol-3-yloxy)propyl]amino]-2,3-difluorophenyl]pyridin-2-yl]imidazolidin-2-one

Drug info:

PubChemData

Smile

CCC1=NOC(=N1)N2CCC(CC2)C(C)OC3=CN=C(N=C3)N4CC(C(C4)N5C=C(C=CC5=O)F)N

DOS

IR

Vibrations