Geometry & MOs

Info

ID:	413099
PubChem CID:	135086043
Reduced:	N4O6C25H30 (1)
Stoich.:	A4B6C25D30 (1)
Weight, g/mol:	488.10592
ΔH_f, kcal/mol:	-160.76
Dipole, Da:	3.8
IP(EA), eV:	-8.68(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (3E)-2-[(4-bromophenyl)-phenyldiazenylmethyl]-3-(ethoxycarbonylhydrazinylidene)butanoate

Drug info:

PubChemData

Smile

C/C(=N\NC(=O)OC(C)(C)C)/C(C(C1=CC=C(C=C1)C(=O)OC)N=NC2=CC=CC=C2)C(=O)OC

DOS

IR

Vibrations