Geometry & MOs

Info

ID:	122418
PubChem CID:	50805696
Reduced:	ClO2N3C22H24 (1)
Stoich.:	AB2C3D22E24 (1)
Weight, g/mol:	370.03169
ΔH_f, kcal/mol:	-9.52
Dipole, Da:	4.55
IP(EA), eV:	-7.64(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-bromophenyl)-5-methyl-N-(2-methylphenyl)-1,2-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C1=CC(=C(C=C1)NC(=O)C2=C(ON=C2C3=CC=CC=C3Cl)C)C

DOS

IR

Vibrations