Geometry & MOs

Info

ID:	121702
PubChem CID:	50778194
Reduced:	N4O4H18C19 (1)
Stoich.:	A4B4C18D19 (1)
Weight, g/mol:	354.149204
ΔH_f, kcal/mol:	-45.88
Dipole, Da:	6.34
IP(EA), eV:	-8.86(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-[5-(3-fluoro-4-methylphenyl)-1,2,4-oxadiazol-3-yl]phenyl]-3-propan-2-ylurea

Drug info:

PubChemData

Smile

CC(C)NC(=O)NC1=CC=CC(=C1)C2=NOC(=N2)C3=CC4=C(C=C3)OCO4

DOS

IR

Vibrations