Geometry & MOs

Info

ID:	406929
PubChem CID:	135078946
Reduced:	O4C17H24 (1)
Stoich.:	A4B17C24 (1)
Weight, g/mol:	270.067428
ΔH_f, kcal/mol:	-135.48
Dipole, Da:	0.94
IP(EA), eV:	-8.95(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-dimethoxy-N-[(E)-1-methylsulfanyl-2-nitroethenyl]aniline

Drug info:

PubChemData

Smile

CC(=C=CCC(C/C(=C/C=C)/C)(C(=O)OC)C(=O)OC)C

DOS

IR

Vibrations