Geometry & MOs

Info

ID:	422649
PubChem CID:	135118191
Reduced:	N2O4C19H28 (1)
Stoich.:	A2B4C19D28 (1)
Weight, g/mol:	375.179421
ΔH_f, kcal/mol:	-186.55
Dipole, Da:	0.82
IP(EA), eV:	-9.43(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,4S)-3-benzyl-4-hydroxy-1-[[3-(2-methoxyethyl)-1,2,4-oxadiazol-5-yl]methyl]piperidine-3-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)(C)NC(=O)CN1CC[C@]([C@H](C1)O)(CC2=CC=CC=C2)C(=O)O

DOS

IR

Vibrations