Geometry & MOs

Info

ID:	203581
PubChem CID:	79847951
Reduced:	ON2C6H11 (2)
Stoich.:	AB2C6D11 (2)
Weight, g/mol:	243.092915
ΔH_f, kcal/mol:	-41.64
Dipole, Da:	4.09
IP(EA), eV:	-10.08(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(thiolane-3-carbonylamino)cyclobutyl]acetic acid

Drug info:

PubChemData

Smile

CC1(CCCCC1(C(=O)O)NCCCN=[N+]=[N-])C

DOS

IR

Vibrations