Geometry & MOs

Info

ID:	211507
PubChem CID:	81044187
Reduced:	SN2O3C14H26 (1)
Stoich.:	AB2C3D14E26 (1)
Weight, g/mol:	272.173607
ΔH_f, kcal/mol:	-165.67
Dipole, Da:	7.63
IP(EA), eV:	-9.31(0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hydroxy-2-(3-piperidin-3-ylbutanoylamino)butanoic acid

Drug info:

PubChemData

Smile

CC(CC(=O)NCC1CCS(=O)(=O)C1)C2CCCNC2

DOS

IR

Vibrations