Geometry & MOs

Info

ID:	138068
PubChem CID:	52305540
Reduced:	O3N4C16H24 (1)
Stoich.:	A3B4C16D24 (1)
Weight, g/mol:	370.225643
ΔH_f, kcal/mol:	-126.59
Dipole, Da:	7.18
IP(EA), eV:	-8.88(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-N-[[(3S)-oxolan-3-yl]methyl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=NN1C[C@@H](C)CNC(=O)CCN2C(=O)CCC2=O)C

DOS

IR

Vibrations