Geometry & MOs

Info

ID:	280350
PubChem CID:	103848561
Reduced:	N2F3O3C13H15 (1)
Stoich.:	A2B3C3D13E15 (1)
Weight, g/mol:	304.038148
ΔH_f, kcal/mol:	-277.45
Dipole, Da:	6.54
IP(EA), eV:	-9.3(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,5-dichlorophenyl)-3-[(3-hydroxyoxolan-3-yl)methyl]urea

Drug info:

PubChemData

Smile

C1COCC1(CNC(=O)NC2=CC=CC(=C2)C(F)(F)F)O

DOS

IR

Vibrations