Geometry & MOs

Info

ID:

150287

PubChem CID:

53789975

Reduced:

N4C23H25 (1)

Stoich.:

A4B23C25 (1)

Weight, g/mol:

114.115698

ΔHf, kcal/mol:

153.04

Dipole, Da:

5.06

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.806687

Charge, e:

 0

Chem-info

IUPAC name:

4,5-dimethylpyrrolidin-3-amine

Drug info:

PubChemData

Smile

CCCCC1=NC(=N[N+]1(C)C2=CC=C(C=C2)C3=CC=CC=C3C#N)C4CC4

DOS

IR

Vibrations