Geometry & MOs

Info

ID:	353954
PubChem CID:	127285594
Reduced:	FSN3O4C16H22 (1)
Stoich.:	ABC3D4E16F22 (1)
Weight, g/mol:	333.205242
ΔH_f, kcal/mol:	-188.39
Dipole, Da:	4.15
IP(EA), eV:	-9.4(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[cyclopentyl(methyl)amino]ethyl]-3-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)urea

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)N2CCOCC2)NS(=O)(=O)C3=CC=CC(=C3)F

DOS

IR

Vibrations