Geometry & MOs

Info

ID:	323096
PubChem CID:	126672379
Reduced:	Cl2O2N3H13C16 (1)
Stoich.:	A2B2C3D13E16 (1)
Weight, g/mol:	310.334799
ΔH_f, kcal/mol:	-21.98
Dipole, Da:	3.4
IP(EA), eV:	-9.04(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-hexadecan-8-ylpiperazine

Drug info:

PubChemData

Smile

CN1C=NC(=C1C2=CC(=C(C=C2)Cl)Cl)C3=NC=CC(=C3)C(O)O

DOS

IR

Vibrations