Geometry & MOs

Info

ID:	164003
PubChem CID:	74381340
Reduced:	ON6H20C23 (1)
Stoich.:	AB6C20D23 (1)
Weight, g/mol:	456.190989
ΔH_f, kcal/mol:	91.48
Dipole, Da:	7.01
IP(EA), eV:	-8.91(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[1-[[6-(2,6-dimethoxypyridin-3-yl)pyrazin-2-yl]amino]ethyl]phenyl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C1=CC(=CC=C1)NC(=O)C2=CN=CC=C2)NC3=NC(=CN=C3)C4=CC=NC=C4

DOS

IR

Vibrations