Geometry & MOs

Info

ID:	138911
PubChem CID:	52441779
Reduced:	Cl2O2N3C18H25 (1)
Stoich.:	A2B2C3D18E25 (1)
Weight, g/mol:	266.179442
ΔH_f, kcal/mol:	-93.78
Dipole, Da:	5.06
IP(EA), eV:	-8.66(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2R)-2-ethylhexyl]-3-(2-fluorophenyl)urea

Drug info:

PubChemData

Smile

C1CCC(CC1)(CNC(=O)NC2=C(C=C(C=C2)Cl)Cl)N3CCOCC3

DOS

IR

Vibrations