Geometry & MOs

Info

ID:

410576

PubChem CID:

135083376

Reduced:

NC16H16 (1)

Stoich.:

AB16C16 (1)

Weight, g/mol:

289.084642

ΔHf, kcal/mol:

79.83

Dipole, Da:

1.65

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 1.182274

Charge, e:

 1

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CN(C1=CC=CC=C1)[C](C=C)C2=CC=CC=C2

DOS

IR

Vibrations