Geometry & MOs

Info

ID:

317850

PubChem CID:

126646478

Reduced:

NSO4F5H24C26 (1)

Stoich.:

ABC4D5E24F26 (1)

Weight, g/mol:

613.176043

ΔHf, kcal/mol:

-328.71

Dipole, Da:

10.07

IP(EA), eV:

 -9.7(-1.13)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[[2-chloro-3-(trifluoromethyl)phenyl]methyl]-N-(2,2-diphenylethyl)-3-[(1-methyl-1-oxo-3H-2,1lambda5-benzoxaphosphol-6-yl)oxy]propan-1-amine

Drug info:

PubChemData

Smile

CS(=O)(=O)C1=CC(=CC(=C1C=O)F)OCCCN(CC2=CC=C(C=C2)F)CC3=CC(=CC=C3)C(F)(F)F

DOS

IR

Vibrations