Geometry & MOs

Info

ID:	404964
PubChem CID:	135071969
Reduced:	N2O5C18H24 (1)
Stoich.:	A2B5C18D24 (1)
Weight, g/mol:	449.206304
ΔH_f, kcal/mol:	-147.75
Dipole, Da:	4.19
IP(EA), eV:	-8.76(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (3E)-2-[(4-cyanophenyl)-phenyldiazenylmethyl]-3-[(2-methylpropan-2-yl)oxycarbonylhydrazinylidene]butanoate

Drug info:

PubChemData

Smile

CC(C)OC(=O)NN(CC#CC1=CC=CC=C1OC)C(=O)OC(C)C

DOS

IR

Vibrations