Geometry & MOs

Info

ID:	16048
PubChem CID:	458640
Reduced:	BrNO4C10H20 (1)
Stoich.:	ABC4D10E20 (1)
Weight, g/mol:	297.05757
ΔH_f, kcal/mol:	-183.79
Dipole, Da:	11.13
IP(EA), eV:	-8.8(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1,3-diethoxy-1,3-dioxopropan-2-yl)-trimethylazanium;bromide

Drug info:

PubChemData

Smile

CCOC(=O)C(C(=O)OCC)[N+](C)(C)C.[Br-]

DOS

IR

Vibrations