Geometry & MOs

Info

ID:	404965
PubChem CID:	135071970
Reduced:	O4N5C24H27 (1)
Stoich.:	A4B5C24D27 (1)
Weight, g/mol:	472.187733
ΔH_f, kcal/mol:	-45.11
Dipole, Da:	5.56
IP(EA), eV:	-8.76(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (3E)-2-[(4-chlorophenyl)-phenyldiazenylmethyl]-3-[(2-methylpropan-2-yl)oxycarbonylhydrazinylidene]pentanoate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations