Geometry & MOs

Info

ID:

379485

PubChem CID:

134436024

Reduced:

O4N7C30H39 (1)

Stoich.:

A4B7C30D39 (1)

Weight, g/mol:

497.24269

ΔHf, kcal/mol:

-80.81

Dipole, Da:

2.86

IP(EA), eV:

 -8.56(-1.02)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

6-ethoxy-4-[6-[4-(hydroxymethyl)-4-[(4-methoxyphenyl)methyl]piperidin-1-yl]pyridin-3-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1(CCN(CC1)C2=CN=C(C=C2)C3=CC(=CN4C3=C(C=N4)C#N)OCCN5CCOCC5)NC(=O)OC(C)(C)C

DOS

IR

Vibrations