Geometry & MOs

Info

ID:	184301
PubChem CID:	77142694
Reduced:	S2N4O5F6C18H30 (1)
Stoich.:	A2B4C5D6E18F30 (1)
Weight, g/mol:	383.103493
ΔH_f, kcal/mol:	-533.05
Dipole, Da:	11.15
IP(EA), eV:	-10.08(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-benzyl-3-(8-methyl-2-oxo-4H-1,3,2lambda5-benzodioxaphosphinin-2-yl)-1,3-oxazolidin-2-ylidene]cyanamide

Drug info:

PubChemData

Smile

CCCCNC(=O)C(C(C)C)N1C=C[N+](=C1)CCCC.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F

DOS

IR

Vibrations