Geometry & MOs

Info

ID:	393709
PubChem CID:	135021502
Reduced:	OPN3H20C22 (1)
Stoich.:	ABC3D20E22 (1)
Weight, g/mol:	398.079585
ΔH_f, kcal/mol:	81.73
Dipole, Da:	5.88
IP(EA), eV:	-8.48(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diphenyl-[5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-yl]phosphane

Drug info:

PubChemData

Smile

CN(C)C1=CC=CC(=C1)C2=NN=C(O2)P(C3=CC=CC=C3)C4=CC=CC=C4

DOS

IR

Vibrations