Geometry & MOs

Info

ID:	212204
PubChem CID:	81059805
Reduced:	N2O2C11H20 (1)
Stoich.:	A2B2C11D20 (1)
Weight, g/mol:	258.184447
ΔH_f, kcal/mol:	-57.26
Dipole, Da:	2.38
IP(EA), eV:	-9.06(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethyl-4-(3,3,4-trimethylpiperazin-1-yl)pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CCOCCN(C)C(CN)C1=COC=C1

DOS

IR

Vibrations