Geometry & MOs

Info

ID:	212863
PubChem CID:	81062038
Reduced:	SN2O3C12H20 (1)
Stoich.:	AB2C3D12E20 (1)
Weight, g/mol:	286.189257
ΔH_f, kcal/mol:	-111.52
Dipole, Da:	4.83
IP(EA), eV:	-8.58(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[[methyl(2-propan-2-yloxyethyl)carbamoyl]amino]methyl]cyclopentane-1-carboxylic acid

Drug info:

PubChemData

Smile

CCOCCN(C)S(=O)(=O)C1=CC=CC=C1NC

DOS

IR

Vibrations