Geometry & MOs

Info

ID:	225374
PubChem CID:	85756526
Reduced:	OSN3H9C10 (1)
Stoich.:	ABC3D9E10 (1)
Weight, g/mol:	311.107005
ΔH_f, kcal/mol:	55.14
Dipole, Da:	4.5
IP(EA), eV:	-8.89(-1.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=O)C(=NNC2=NC=CS2)C=C1

DOS

IR

Vibrations