Geometry & MOs

Info

ID:	25350
PubChem CID:	623489
Reduced:	OC2H2 (16)
Stoich.:	AB2C2 (16)
Weight, g/mol:	421.02872
ΔH_f, kcal/mol:	-604.26
Dipole, Da:	4.68
IP(EA), eV:	-8.65(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,4-dimethylphenyl)-N'-[(4-iodophenyl)methylideneamino]oxamide

Drug info:

PubChemData

Smile

CC1C(C(C(C(O1)OC2=CC=C(C=C2)C3=C(C(=O)C4=C(C(=C(C=C4O3)OC(=O)C)OC(=O)C)OC)O)OC(=O)C)OC(=O)C)OC(=O)C

DOS

IR

Vibrations