Geometry & MOs

Info

ID:

70892

PubChem CID:

48414007

Reduced:

O2N5C16H17 (1)

Stoich.:

A2B5C16D17 (1)

Weight, g/mol:

282.122909

ΔHf, kcal/mol:

-5.15

Dipole, Da:

5.11

IP(EA), eV:

-9.25(-1.05)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-[(5-methyl-1H-pyrazol-4-yl)methyl]-6-pyrazol-1-ylpyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1)CNC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C

DOS

IR

Vibrations