Geometry & MOs

Info

ID:	413444
PubChem CID:	135086393
Reduced:	NF3O3C18H20 (1)
Stoich.:	AB3C3D18E20 (1)
Weight, g/mol:	334.112267
ΔH_f, kcal/mol:	-283.27
Dipole, Da:	2.0
IP(EA), eV:	-10.33(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-diphenylphosphorylethenyl)-4-methoxybenzene

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCC/C(=C\C2=CC=C(C=C2)C(F)(F)F)/C1=O

DOS

IR

Vibrations