Geometry & MOs

Info

ID:	399139
PubChem CID:	135038114
Reduced:	NOC16H25 (1)
Stoich.:	ABC16D25 (1)
Weight, g/mol:	215.152144
ΔH_f, kcal/mol:	-62.61
Dipole, Da:	2.53
IP(EA), eV:	-9.62(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (2R,3R,6S)-3-hydroxy-6-propylpiperidine-2-carboxylate

Drug info:

PubChemData

Smile

CC1CCC(C(C1)(C2=CC=CC(=N2)C)O)C(C)C

DOS

IR

Vibrations