Geometry & MOs

Info

ID:	183186
PubChem CID:	76988947
Reduced:	SN3O4C11H21 (1)
Stoich.:	AB3C4D11E21 (1)
Weight, g/mol:	243.110673
ΔH_f, kcal/mol:	-121.21
Dipole, Da:	5.65
IP(EA), eV:	-8.84(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopentanecarbonylamino)-4-methoxy-4-oxobutanoic acid

Drug info:

PubChemData

Smile

C1CC(OC1)CS(=O)(=O)N(CCC(=NO)N)C2CC2

DOS

IR

Vibrations