Geometry & MOs

Info

ID:

330158

PubChem CID:

127247145

Reduced:

N2C9H10 (2)

Stoich.:

A2B9C10 (2)

Weight, g/mol:

295.14331

ΔHf, kcal/mol:

79.0

Dipole, Da:

2.99

IP(EA), eV:

-9.14(-0.69)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1H-indazol-3-yl-[3-(4-methyl-1H-pyrazol-5-yl)pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=C(NN=C1)C2CCN(C2)CC3=CC4=C(C=C3)N=CC=C4

DOS

IR

Vibrations