Geometry & MOs

Info

ID:	384983
PubChem CID:	134978083
Reduced:	NPO3C15H32 (1)
Stoich.:	ABC3D15E32 (1)
Weight, g/mol:	496.093246
ΔH_f, kcal/mol:	-240.74
Dipole, Da:	1.19
IP(EA), eV:	-8.69(1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[3-[[butyl(ethoxy)phosphoryl]oxymethyl]phenoxy]phenyl] trifluoromethanesulfonate

Drug info:

PubChemData

Smile

CCP(=O)(O)OC.C1CCC(CC1)NC2CCCCC2

DOS

IR

Vibrations