Geometry & MOs

Info

ID:	358879
PubChem CID:	127296750
Reduced:	ON3C18H27 (1)
Stoich.:	AB3C18D27 (1)
Weight, g/mol:	391.294725
ΔH_f, kcal/mol:	-57.11
Dipole, Da:	5.52
IP(EA), eV:	-9.61(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-4-[(1-methylpiperidin-2-yl)methyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

C[C@@H](C1=CN=CC=C1)NC(=O)NC2CCC3CCCCC3C2

DOS

IR

Vibrations