Geometry & MOs

Info

ID:	315936
PubChem CID:	126629465
Reduced:	BrON3C19H24 (1)
Stoich.:	ABC3D19E24 (1)
Weight, g/mol:	271.109921
ΔH_f, kcal/mol:	118.38
Dipole, Da:	23.5
IP(EA), eV:	-6.42(-2.73)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[2,6-di(propan-2-yl)phenoxy]methoxy-hydroxy-oxophosphanium

Drug info:

PubChemData

Smile

CC1=NC2(C3=C(CC24CCC(CC4)OC)C=CC(=C3)Br)N=C1NC

DOS

IR

Vibrations