Geometry & MOs

Info

ID:	225368
PubChem CID:	85756520
Reduced:	O2F3N3H14C18 (1)
Stoich.:	A2B3C3D14E18 (1)
Weight, g/mol:	313.061804
ΔH_f, kcal/mol:	-169.05
Dipole, Da:	6.88
IP(EA), eV:	-8.98(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-chloro-4-(1,3-oxazol-5-yl)phenyl]-3-phenylurea

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)NC(=O)NC2=CC=C(C=C2)C3=CN=CO3)C(F)(F)F

DOS

IR

Vibrations