Geometry & MOs

Info

ID:	346940
PubChem CID:	127271444
Reduced:	ON4C10H16 (1)
Stoich.:	AB4C10D16 (1)
Weight, g/mol:	337.18017
ΔH_f, kcal/mol:	-20.82
Dipole, Da:	5.1
IP(EA), eV:	-9.12(0.58)
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-piperidin-1-ylethyl)urea

Drug info:

PubChemData

Smile

CNC(=O)N1CCC(CC1)C2=NC=CN2

DOS

IR

Vibrations