Geometry & MOs

Info

ID:	225308
PubChem CID:	85756460
Reduced:	N3O3C12H19 (2)
Stoich.:	A3B3C12D19 (2)
Weight, g/mol:	327.077454
ΔH_f, kcal/mol:	-290.89
Dipole, Da:	3.49
IP(EA), eV:	-8.73(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCCC(C(=O)NC(CO)C(=O)N)NC(=O)C(C)NC(=O)C(C(C)C)NC(=O)C1=CC=CC=C1N

DOS

IR

Vibrations