Geometry & MOs

Info

ID:	79831
PubChem CID:	49830685
Reduced:	OF3N4H13C17 (1)
Stoich.:	AB3C4D13E17 (1)
Weight, g/mol:	350.079074
ΔH_f, kcal/mol:	-127.69
Dipole, Da:	6.63
IP(EA), eV:	-8.88(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(7-fluoroquinolin-4-yl)-3-[6-(trifluoromethyl)pyridin-2-yl]urea

Drug info:

PubChemData

Smile

CC1=CC2=C(C=CN=C2C=C1)NC(=O)NC3=CC=CC(=N3)C(F)(F)F

DOS

IR

Vibrations