Geometry & MOs

Info

ID:	225312
PubChem CID:	85756464
Reduced:	ClNO2C5H10 (1)
Stoich.:	ABC2D5E10 (1)
Weight, g/mol:	323.126991
ΔH_f, kcal/mol:	-114.94
Dipole, Da:	4.81
IP(EA), eV:	-10.2(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methoxy-5-methylphenyl)-3-[4-(1,3-oxazol-5-yl)phenyl]urea

Drug info:

PubChemData

Smile

C=CC(CC(=O)O)N.Cl

DOS

IR

Vibrations