Geometry & MOs

Info

ID:	353730
PubChem CID:	127285307
Reduced:	O3N5C19H29 (1)
Stoich.:	A3B5C19D29 (1)
Weight, g/mol:	334.200491
ΔH_f, kcal/mol:	-112.6
Dipole, Da:	6.63
IP(EA), eV:	-8.72(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(4-methoxypyridin-2-yl)piperazin-1-yl]-N-(oxan-4-yl)acetamide

Drug info:

PubChemData

Smile

CC(=O)N1CCC(CC1)NC(=O)CN2CCN(CC2)C3=NC=CC(=C3)OC

DOS

IR

Vibrations