Geometry & MOs

Info

ID:	47766
PubChem CID:	10535187
Reduced:	NC12H13 (1)
Stoich.:	AB12C13 (1)
Weight, g/mol:	171.104799
ΔH_f, kcal/mol:	109.18
Dipole, Da:	1.09
IP(EA), eV:	-6.18(-1.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1C[CH+]C(=C1)C=C2[CH-]C=C(C=C2)N

DOS

IR

Vibrations