Geometry & MOs

Info

ID:

184458

PubChem CID:

77162279

Reduced:

O3N5H17C23 (1)

Stoich.:

A3B5C17D23 (1)

Weight, g/mol:

585.154574

ΔHf, kcal/mol:

56.38

Dipole, Da:

5.25

IP(EA), eV:

 -9.4(-2.31)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[1-(2,4-dichlorophenyl)-7-[(4-methoxyphenyl)methylidene]-3-(piperidin-1-ylcarbamoyl)-4,6-dihydropyrazolo[4,3-c]pyridin-5-yl] methyl carbonate

Drug info:

PubChemData

Smile

CN(C)CC1=CN=C2C=CC(=O)C(=C3C(=C4C=NC5=CC=CC=C54)C(=O)NC3=O)C2=N1

DOS

IR

Vibrations