Geometry & MOs

Info

ID:	356115
PubChem CID:	127291151
Reduced:	N2O2C13H24 (1)
Stoich.:	A2B2C13D24 (1)
Weight, g/mol:	310.200491
ΔH_f, kcal/mol:	-118.11
Dipole, Da:	2.6
IP(EA), eV:	-9.17(1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(cyclopropylamino)-2-oxoethyl]-N-(oxan-3-yl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CN(C1CCCCC1)C(=O)NC2CCCOC2

DOS

IR

Vibrations