Geometry & MOs

Info

ID:	346744
PubChem CID:	127271248
Reduced:	FN3O3C18H26 (1)
Stoich.:	AB3C3D18E26 (1)
Weight, g/mol:	351.19582
ΔH_f, kcal/mol:	-166.54
Dipole, Da:	6.51
IP(EA), eV:	-8.91(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]-3-[2-(3-methylpiperidin-1-yl)ethyl]urea

Drug info:

PubChemData

Smile

CC1CCN(CC1)CCNC(=O)NCC2=CC(=CC3=C2OCOC3)F

DOS

IR

Vibrations