Geometry & MOs

Info

ID:	136826
PubChem CID:	52108262
Reduced:	N4C15H20 (1)
Stoich.:	A4B15C20 (1)
Weight, g/mol:	257.176622
ΔH_f, kcal/mol:	37.81
Dipole, Da:	2.79
IP(EA), eV:	-8.1(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

N-methyl-2-[(3R)-3-methylpiperidin-1-yl]quinazolin-3-ium-4-amine

Drug info:

PubChemData

Smile

C[C@H]1CCCCN1C2=NC3=CC=CC=C3C(=N2)NC

DOS

IR

Vibrations