Geometry & MOs

Info

ID:	361262
PubChem CID:	127302426
Reduced:	O2N3C18H23 (1)
Stoich.:	A2B3C18D23 (1)
Weight, g/mol:	378.299476
ΔH_f, kcal/mol:	-20.84
Dipole, Da:	6.61
IP(EA), eV:	-9.02(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-3-methyl-1-oxo-1-(4-piperidin-1-ylpiperidin-1-yl)pentan-2-yl]pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)C(C)N(C1CC1)C(=O)C2=NN(C3=CC=CC=C3C2=O)C

DOS

IR

Vibrations