Geometry & MOs

Info

ID:

413669

PubChem CID:

135086618

Reduced:

O2N3C13H15 (1)

Stoich.:

A2B3C13D15 (1)

Weight, g/mol:

214.006454

ΔHf, kcal/mol:

11.06

Dipole, Da:

2.65

IP(EA), eV:

-9.64(-0.37)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2,3-dichloro-5-(3,4-dihydro-2H-pyrrol-5-yl)pyridine

Drug info:

PubChemData

Smile

CCOC(=O)C1CC1(C2=CC=C(C=C2)C)N=[N+]=[N-]

DOS

IR

Vibrations