Geometry & MOs

Info

ID:

416864

PubChem CID:

135090615

Reduced:

O5N7C28H37 (1)

Stoich.:

A5B7C28D37 (1)

Weight, g/mol:

366.180424

ΔHf, kcal/mol:

-168.75

Dipole, Da:

7.84

IP(EA), eV:

 -9.56(0.0)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-methyl-5-[[[(2S)-5-oxopyrrolidin-2-yl]methyl-(pyridin-2-ylmethyl)amino]methyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one

Drug info:

PubChemData

Smile

C[C@H]1C(=O)N2CCC[C@@H]2C(=O)N[C@H](C(=O)N[C@H](CN(CC(=O)N1)C(=O)C3=CN=CN3)CC4=CC=CC=C4)C(C)C

DOS

IR

Vibrations