Geometry & MOs

Info

ID:	140646
PubChem CID:	52735117
Reduced:	N2O2C11H16 (2)
Stoich.:	A2B2C11D16 (2)
Weight, g/mol:	391.319878
ΔH_f, kcal/mol:	-143.97
Dipole, Da:	6.34
IP(EA), eV:	-9.1(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-(cyclohexanecarbonyl)-N-[2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-methylpropyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)N(C[C@@H]1CCCN(C1)C(=O)C2=NNC(=C2)C3=CC=CO3)C(=O)OC(C)(C)C

DOS

IR

Vibrations