Geometry & MOs

Info

ID:	296303
PubChem CID:	117566967
Reduced:	ON2C13H20 (1)
Stoich.:	AB2C13D20 (1)
Weight, g/mol:	213.184112
ΔH_f, kcal/mol:	-39.99
Dipole, Da:	2.62
IP(EA), eV:	-8.55(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[4-(methylamino)butyl]piperazin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC(=O)C1=CC(=CC=C1)NCCC(C)(C)N

DOS

IR

Vibrations