Geometry & MOs

Info

ID:	332053
PubChem CID:	127250339
Reduced:	ON6C25H28 (1)
Stoich.:	AB6C25D28 (1)
Weight, g/mol:	426.216809
ΔH_f, kcal/mol:	56.25
Dipole, Da:	3.0
IP(EA), eV:	-8.78(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-3-[[2-(5-pyrimidin-5-ylpyridin-2-yl)morpholin-4-yl]methyl]quinolin-2-amine

Drug info:

PubChemData

Smile

CC(C)N1C2=CC=CC=C2N=C1CN3CCOC(C3)C4=NC=C(C=C4)C5=CN=C(C=C5)N

DOS

IR

Vibrations