Geometry & MOs

Info

ID:	424270
PubChem CID:	135121993
Reduced:	O2N4C9H16 (1)
Stoich.:	A2B4C9D16 (1)
Weight, g/mol:	254.960375
ΔH_f, kcal/mol:	-93.94
Dipole, Da:	2.54
IP(EA), eV:	-9.38(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

potassium;nitro(phenyl)methanesulfonate

Drug info:

PubChemData

Smile

CC(=O)NCCCC1(C=CNC(=O)N1)N

DOS

IR

Vibrations