Geometry & MOs

Info

ID:	351322
PubChem CID:	127280210
Reduced:	O2N4C23H30 (1)
Stoich.:	A2B4C23D30 (1)
Weight, g/mol:	351.252192
ΔH_f, kcal/mol:	-46.65
Dipole, Da:	4.34
IP(EA), eV:	-8.86(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-N-methyl-2-[4-(oxane-4-carbonyl)piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CN(C1CCCCC1)C(=O)CN2CCN(CC2)C(=O)C3=CC=CC4=C3N=CC=C4

DOS

IR

Vibrations