Geometry & MOs

Info

ID:	405903
PubChem CID:	135075902
Reduced:	O2N3H15C20 (1)
Stoich.:	A2B3C15D20 (1)
Weight, g/mol:	471.10905
ΔH_f, kcal/mol:	51.85
Dipole, Da:	9.15
IP(EA), eV:	-9.04(-2.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2Z)-N-(2-iodophenyl)-2,5-dimethyl-N-(2-trimethylsilylethoxymethyl)hexa-2,4-dienamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)N(C(=O)C2=C(C#N)C#N)CC3=CC=C(C=C3)OC

DOS

IR

Vibrations