Geometry & MOs

Info

ID:	261296
PubChem CID:	103225480
Reduced:	OSN2C8H18 (1)
Stoich.:	ABC2D8E18 (1)
Weight, g/mol:	297.16079
ΔH_f, kcal/mol:	-45.64
Dipole, Da:	2.73
IP(EA), eV:	-8.6(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(2-chlorophenyl)piperazin-1-yl]-3-methoxy-N-methylpropan-1-amine

Drug info:

PubChemData

Smile

COCC(CN)N1CCSCC1

DOS

IR

Vibrations