Geometry & MOs

Info

ID:	231333
PubChem CID:	87573492
Reduced:	N2O6C9H12 (1)
Stoich.:	A2B6C9D12 (1)
Weight, g/mol:	410.298354
ΔH_f, kcal/mol:	-217.89
Dipole, Da:	5.91
IP(EA), eV:	-10.4(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methanesulfonate;tributyl(octyl)phosphanium

Drug info:

PubChemData

Smile

C1C(C(=O)N(C1=O)OC(=O)CCCC(=O)O)N

DOS

IR

Vibrations