Geometry & MOs

Info

ID:	365475
PubChem CID:	127317894
Reduced:	N3O3C20H31 (1)
Stoich.:	A3B3C20D31 (1)
Weight, g/mol:	337.247775
ΔH_f, kcal/mol:	-114.02
Dipole, Da:	2.8
IP(EA), eV:	-9.07(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclobutyl-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

COCC1CCCN(C1)C(=O)NCC(C2=CC=CC=C2)N3CCOCC3

DOS

IR

Vibrations