Geometry & MOs

Info

ID:	368857
PubChem CID:	127330817
Reduced:	ON5C20H33 (1)
Stoich.:	AB5C20D33 (1)
Weight, g/mol:	371.268511
ΔH_f, kcal/mol:	-39.9
Dipole, Da:	4.75
IP(EA), eV:	-8.47(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclobutyl-N-[1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CCC1CCCN(C1)C(=O)NC(C)CN2CCN(CC2)C3=CC=CC=N3

DOS

IR

Vibrations