Geometry & MOs

Info

ID:	225338
PubChem CID:	85756490
Reduced:	ClFO2N3H11C16 (1)
Stoich.:	ABC2D3E11F16 (1)
Weight, g/mol:	294.111676
ΔH_f, kcal/mol:	-50.31
Dipole, Da:	5.47
IP(EA), eV:	-8.93(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-aminophenyl)-3-[4-(1,3-oxazol-5-yl)phenyl]urea

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C2=CN=CO2)NC(=O)NC3=CC(=C(C=C3)F)Cl

DOS

IR

Vibrations