Geometry & MOs

Info

ID:	433410
PubChem CID:	135173547
Reduced:	N2O6C17H18 (1)
Stoich.:	A2B6C17D18 (1)
Weight, g/mol:	264.195011
ΔH_f, kcal/mol:	-217.04
Dipole, Da:	6.09
IP(EA), eV:	-9.85(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[6-[3-(4-methylpiperazin-1-yl)propoxy]pyridin-3-yl]methanamine

Drug info:

PubChemData

Smile

CCC(=O)NC(=O)CN1C(=O)C2=C(C1=O)C(=CC=C2)OCCCC=O

DOS

IR

Vibrations