Geometry & MOs

Info

ID:	28895
PubChem CID:	830391
Reduced:	NO3C17H21 (1)
Stoich.:	AB3C17D21 (1)
Weight, g/mol:	329.235479
ΔH_f, kcal/mol:	-105.4
Dipole, Da:	3.82
IP(EA), eV:	-8.35(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-piperidin-1-ylethyl (2S)-2-cyclohexyl-2-phenylacetate

Drug info:

PubChemData

Smile

CC1([C@@H]2CC[C@@](C2)(C1=O)C(=O)NC3=CC=CC=C3OC)C

DOS

IR

Vibrations