Geometry & MOs

Info

ID:	346730
PubChem CID:	127271234
Reduced:	FN3O4C18H26 (1)
Stoich.:	AB3C4D18E26 (1)
Weight, g/mol:	337.143784
ΔH_f, kcal/mol:	-204.6
Dipole, Da:	1.91
IP(EA), eV:	-8.8(-0.53)
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-oxo-2-pyrrolidin-1-ylethyl)urea

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)NCC1=CC(=CC2=C1OCOC2)F)N3CCOCC3

DOS

IR

Vibrations