Geometry & MOs

Info

ID:	356130
PubChem CID:	127291166
Reduced:	N2O3C19H28 (1)
Stoich.:	A2B3C19D28 (1)
Weight, g/mol:	338.231791
ΔH_f, kcal/mol:	-126.44
Dipole, Da:	4.64
IP(EA), eV:	-8.78(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(oxan-3-yl)-4-(2-oxo-2-piperidin-1-ylethyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2CCCCCN2C(=O)NC3CCCOC3

DOS

IR

Vibrations