Geometry & MOs

Info

ID:

442857

PubChem CID:

135256625

Reduced:

ON10H24C27 (1)

Stoich.:

AB10C24D27 (1)

Weight, g/mol:

522.22402

ΔHf, kcal/mol:

160.26

Dipole, Da:

8.89

IP(EA), eV:

 -8.86(-1.19)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[1-[5-(6-methoxypyridin-3-yl)pyrazin-2-yl]ethyl]-5-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)C2=CN=C(C=C2)C(=O)NCC3=CN=C(C=C3)C4=CN=CC=C4)NC5=NNC(=C5)CN=C

DOS

IR

Vibrations