Geometry & MOs

Info

ID:	11440
PubChem CID:	115592
Reduced:	NaSN2O2C13H19 (1)
Stoich.:	ABC2D2E13F19 (1)
Weight, g/mol:	290.106493
ΔH_f, kcal/mol:	-131.95
Dipole, Da:	11.29
IP(EA), eV:	-8.94(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

sodium;1,2-dimethyl-10-oxo-4-propyl-8-sulfanyl-7,9-diazaspiro[4.5]deca-6,8-dien-6-olate

Drug info:

PubChemData

Smile

CCCC1CC(C(C12C(=NC(=NC2=O)S)[O-])C)C.[Na+]

DOS

IR

Vibrations