Geometry & MOs

Info

ID:	282401
PubChem CID:	103925327
Reduced:	NO2C13H25 (1)
Stoich.:	AB2C13D25 (1)
Weight, g/mol:	257.108565
ΔH_f, kcal/mol:	-136.93
Dipole, Da:	2.25
IP(EA), eV:	-9.16(1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(2-cyclobutylacetyl)thiomorpholin-3-yl]acetic acid

Drug info:

PubChemData

Smile

C[C@@H](C(=O)OC(C)(C)C)NCC1CCCC1

DOS

IR

Vibrations