Geometry & MOs

Info

ID:	422588
PubChem CID:	135118090
Reduced:	ON4C17H24 (1)
Stoich.:	AB4C17D24 (1)
Weight, g/mol:	343.178358
ΔH_f, kcal/mol:	-16.08
Dipole, Da:	6.17
IP(EA), eV:	-8.6(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,4S)-3-benzyl-1-[(4,5-dimethylfuran-2-yl)methyl]-4-hydroxypiperidine-3-carboxylic acid

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)N=C(N2)CN(C)C(C)C(=O)N3CCCC3

DOS

IR

Vibrations