Geometry & MOs

Info

ID:	296317
PubChem CID:	117568025
Reduced:	ON2C11H18 (1)
Stoich.:	AB2C11D18 (1)
Weight, g/mol:	233.189198
ΔH_f, kcal/mol:	-20.71
Dipole, Da:	0.93
IP(EA), eV:	-8.14(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4-ethylpiperazin-1-yl)methyl]-N-methylaniline

Drug info:

PubChemData

Smile

CNC1=CC=C(C=C1)CNCCOC

DOS

IR

Vibrations