Geometry & MOs

Info

ID:	59392
PubChem CID:	24850553
Reduced:	SN2H6C12F14 (1)
Stoich.:	AB2C6D12E14 (1)
Weight, g/mol:	299.143901
ΔH_f, kcal/mol:	-655.81
Dipole, Da:	4.01
IP(EA), eV:	-10.33(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methoxy-N-[[(2S)-1-phenylphospholan-2-yl]methyl]aniline

Drug info:

PubChemData

Smile

C(CSC(F)(F)F)C(CC(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(C#N)C#N

DOS

IR

Vibrations