Geometry & MOs

Info

ID:	225809
PubChem CID:	87226395
Reduced:	SO3C9H18 (1)
Stoich.:	AB3C9D18 (1)
Weight, g/mol:	258.194343
ΔH_f, kcal/mol:	-150.56
Dipole, Da:	3.69
IP(EA), eV:	-10.25(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(pentanoylamino)-2-(trimethylazaniumyl)pentanoate

Drug info:

PubChemData

Smile

CCCCCC/C=C/CS(=O)(=O)O

DOS

IR

Vibrations