Geometry & MOs

Info

ID:	422565
PubChem CID:	135118047
Reduced:	O2N4C15H22 (1)
Stoich.:	A2B4C15D22 (1)
Weight, g/mol:	359.209658
ΔH_f, kcal/mol:	-46.83
Dipole, Da:	4.68
IP(EA), eV:	-8.59(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R,4S)-4-benzyl-3-hydroxy-1-(2,2,3,3-tetramethylcyclopropanecarbonyl)piperidine-4-carboxylic acid

Drug info:

PubChemData

Smile

CN(C)C1=NC=C(C=C1)CN2C[C@@H]3COC[C@H](C2)NC3=O

DOS

IR

Vibrations