Geometry & MOs

Info

ID:	346731
PubChem CID:	127271235
Reduced:	FN3O4C16H20 (1)
Stoich.:	AB3C4D16E20 (1)
Weight, g/mol:	349.18017
ΔH_f, kcal/mol:	-197.04
Dipole, Da:	8.52
IP(EA), eV:	-9.0(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-cyclopropylpiperidin-4-yl)-3-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]urea

Drug info:

PubChemData

Smile

C1CCN(C1)C(=O)CNC(=O)NCC2=CC(=CC3=C2OCOC3)F

DOS

IR

Vibrations