Geometry & MOs

Info

ID:	330714
PubChem CID:	127248121
Reduced:	O2N5C16H21 (1)
Stoich.:	A2B5C16D21 (1)
Weight, g/mol:	344.196074
ΔH_f, kcal/mol:	-13.7
Dipole, Da:	3.12
IP(EA), eV:	-9.22(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidin-3-yl]-N,N-dimethylpyridin-2-amine

Drug info:

PubChemData

Smile

COC1=NC(=NC(=N1)N2CCCC(C2)CC3=CC=CC=N3)OC

DOS

IR

Vibrations