Geometry & MOs

Info

ID:	225365
PubChem CID:	85756517
Reduced:	N3O4H15C18 (1)
Stoich.:	A3B4C15D18 (1)
Weight, g/mol:	338.101505
ΔH_f, kcal/mol:	-68.74
Dipole, Da:	7.09
IP(EA), eV:	-8.52(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1COC2=C(O1)C=CC(=C2)NC(=O)NC3=CC=C(C=C3)C4=CN=CO4

DOS

IR

Vibrations