Geometry & MOs

Info

ID:	413813
PubChem CID:	135086763
Reduced:	N3H17C20 (1)
Stoich.:	A3B17C20 (1)
Weight, g/mol:	252.089878
ΔH_f, kcal/mol:	129.53
Dipole, Da:	1.38
IP(EA), eV:	-8.53(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1Z,3E)-2-diazonio-1-methoxy-4-naphthalen-1-ylbuta-1,3-dien-1-olate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)/C=C/C(=N\NC2=CC=CC=N2)/C3=CC=CC=C3

DOS

IR

Vibrations