Geometry & MOs

Info

ID:

441732

PubChem CID:

135242167

Reduced:

ClON9H30C31 (1)

Stoich.:

ABC9D30E31 (1)

Weight, g/mol:

547.200462

ΔHf, kcal/mol:

146.51

Dipole, Da:

6.76

IP(EA), eV:

 -8.54(-1.18)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methyl 6-(2,3-dichlorophenyl)-5-methyl-3-[4-[(2-methylpropan-2-yl)oxycarbonylamino]-8-azaspiro[4.5]decan-8-yl]pyridine-2-carboxylate

Drug info:

PubChemData

Smile

CN1C=CC(=C1)C2=CN3C(=C(C=N3)C#N)C(=N2)C4=CN=C(C=C4)N5CCN(CC5)C(=O)[C@H](C6=CC(=CC=C6)Cl)N(C)C

DOS

IR

Vibrations