Geometry & MOs

Info

ID:	214022
PubChem CID:	81065823
Reduced:	SO2N3C10H17 (1)
Stoich.:	AB2C3D10E17 (1)
Weight, g/mol:	301.200156
ΔH_f, kcal/mol:	-73.42
Dipole, Da:	4.89
IP(EA), eV:	-9.07(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(1-morpholin-4-ylpropan-2-ylcarbamoylamino)methyl]pentanoic acid

Drug info:

PubChemData

Smile

CC(C)C1=NSC(=N1)NCC(C)CC(=O)O

DOS

IR

Vibrations