Geometry & MOs

Info

ID:	247106
PubChem CID:	103067766
Reduced:	ClNOC12H24 (1)
Stoich.:	ABCD12E24 (1)
Weight, g/mol:	230.154976
ΔH_f, kcal/mol:	-66.23
Dipole, Da:	1.84
IP(EA), eV:	-8.84(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(chloromethyl)prop-2-enyl]-4-(2-methylpropyl)piperazine

Drug info:

PubChemData

Smile

CCC(CC)N(CCOC)CC(=C)CCl

DOS

IR

Vibrations