Geometry & MOs

Info

ID:	228904
PubChem CID:	87566167
Reduced:	FSO2N4C24H29 (1)
Stoich.:	ABC2D4E24F29 (1)
Weight, g/mol:	386.175419
ΔH_f, kcal/mol:	-23.83
Dipole, Da:	3.93
IP(EA), eV:	-8.76(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[3-fluoro-5-(1-formylpiperidin-3-yl)oxyphenyl]methyl]-3-(6-methylpyridin-3-yl)urea

Drug info:

PubChemData

Smile

CN(C)C(=O)CN1C=CC(=N1)/C=C\2/CN(CCC2S)C(C3=CC=CC=C3F)C(=O)C4CC4

DOS

IR

Vibrations