Geometry & MOs

Info

ID:	264675
PubChem CID:	103481637
Reduced:	BrClSN2O2H10C12 (1)
Stoich.:	ABCD2E2F10G12 (1)
Weight, g/mol:	344.06549
ΔH_f, kcal/mol:	-34.01
Dipole, Da:	3.1
IP(EA), eV:	-8.99(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-bromo-3-chlorophenyl)-2-ethyl-5-propylpiperazine

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(SC=N1)NC2=C(C(=CC=C2)Cl)Br

DOS

IR

Vibrations