Geometry & MOs

Info

ID:	343195
PubChem CID:	127266368
Reduced:	O2F3N4C14H15 (1)
Stoich.:	A2B3C4D14E15 (1)
Weight, g/mol:	251.002845
ΔH_f, kcal/mol:	-169.32
Dipole, Da:	5.71
IP(EA), eV:	-8.54(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,2-dichloroethyl)-3-(5-fluoropyridin-2-yl)urea

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)NC(=O)NC2=C(C=C(C=C2)NC)C(F)(F)F

DOS

IR

Vibrations