Geometry & MOs

Info

ID:	332055
PubChem CID:	127250341
Reduced:	ON6C24H26 (1)
Stoich.:	AB6C24D26 (1)
Weight, g/mol:	440.23246
ΔH_f, kcal/mol:	86.85
Dipole, Da:	3.49
IP(EA), eV:	-8.72(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[2-[5-(6-aminopyridin-3-yl)pyridin-2-yl]morpholin-4-yl]methyl]-N,N-dimethylquinolin-2-amine

Drug info:

PubChemData

Smile

CN(C)C1=NC2=CC=CC=C2C=C1CN3CCOC(C3)C4=NC=C(C=C4)C5=CC=NN5

DOS

IR

Vibrations