Geometry & MOs

Info

ID:	356098
PubChem CID:	127291134
Reduced:	O2N3C15H27 (1)
Stoich.:	A2B3C15D27 (1)
Weight, g/mol:	255.194677
ΔH_f, kcal/mol:	-106.67
Dipole, Da:	3.66
IP(EA), eV:	-8.76(1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(oxan-3-yl)-4-propan-2-ylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C1)N2CCN(CC2)C(=O)NC3CCCOC3

DOS

IR

Vibrations