Geometry & MOs

Info

ID:	25612
PubChem CID:	627127
Reduced:	SN2O3C32H36 (1)
Stoich.:	AB2C3D32E36 (1)
Weight, g/mol:	498.96055
ΔH_f, kcal/mol:	-41.31
Dipole, Da:	7.32
IP(EA), eV:	-8.84(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-bromophenyl)-2-[5-(4-bromophenyl)-3-phenyl-4H-1,2-oxazol-5-yl]ethanone

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)NC(CCO)C(CC2=CC=CC=C2)N(CC3=CC=CC=C3)CC4=CC=CC=C4

DOS

IR

Vibrations