Geometry & MOs

Info

ID:

38143

PubChem CID:

8027403

Reduced:

NC8H18 (1)

Stoich.:

AB8C18 (1)

Weight, g/mol:

127.1361

ΔHf, kcal/mol:

3.63

Dipole, Da:

1.63

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.753175

Charge, e:

 0

Chem-info

IUPAC name:

(3S)-3-butylpyrrolidine

Drug info:

PubChemData

Smile

CCCC[C@@H]1CC[NH2+]C1

DOS

IR

Vibrations