Geometry & MOs

Info

ID:	401326
PubChem CID:	135050935
Reduced:	ClNO2H14C15 (1)
Stoich.:	ABC2D14E15 (1)
Weight, g/mol:	476.165365
ΔH_f, kcal/mol:	-34.62
Dipole, Da:	2.88
IP(EA), eV:	-9.84(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-methyl-3-[2-[(triphenyl-lambda5-phosphanylidene)amino]phenyl]-1,2-oxazol-4-yl]ethanone

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(C(C2=CC=CC=C2)(O)OC=N)Cl

DOS

IR

Vibrations