Geometry & MOs

Info

ID:	230267
PubChem CID:	87570545
Reduced:	N2O3C20H26 (1)
Stoich.:	A2B3C20D26 (1)
Weight, g/mol:	137.99868
ΔH_f, kcal/mol:	-86.73
Dipole, Da:	5.75
IP(EA), eV:	-8.57(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methane;2-sulfonylacetic acid

Drug info:

PubChemData

Smile

CCCCCNC1=CC=CC(=C1)C2=CC(=O)C=C(O2)N3CCOCC3

DOS

IR

Vibrations