Geometry & MOs

Info

ID:	213934
PubChem CID:	81065565
Reduced:	SN2O4C11H22 (1)
Stoich.:	AB2C4D11E22 (1)
Weight, g/mol:	281.093309
ΔH_f, kcal/mol:	-195.32
Dipole, Da:	3.21
IP(EA), eV:	-9.77(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4-methoxy-4-oxobutyl)sulfonylamino]-3-methylbutanoic acid

Drug info:

PubChemData

Smile

CC1CCN(CC1)S(=O)(=O)NCC(C)CC(=O)O

DOS

IR

Vibrations