Geometry & MOs

Info

ID:	296251
PubChem CID:	117563228
Reduced:	ON2C15H22 (1)
Stoich.:	AB2C15D22 (1)
Weight, g/mol:	204.066555
ΔH_f, kcal/mol:	-43.86
Dipole, Da:	3.94
IP(EA), eV:	-8.54(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-chloropropanoyl)piperazine-1-carbaldehyde

Drug info:

PubChemData

Smile

CNC1=CC=CC(=C1)C(=O)NC2CCCCCC2

DOS

IR

Vibrations