Geometry & MOs

Info

ID:

384757

PubChem CID:

134977619

Reduced:

ClNH7C11 (1)

Stoich.:

ABC7D11 (1)

Weight, g/mol:

301.928741

ΔHf, kcal/mol:

150.49

Dipole, Da:

2.88

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 2.402468

Charge, e:

 0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1=CC=[N+](C=C1)C2=C[C]=C([C]=C2)Cl

DOS

IR

Vibrations