Geometry & MOs

Info

ID:	386470
PubChem CID:	134981857
Reduced:	NOH21C27 (1)
Stoich.:	ABC21D27 (1)
Weight, g/mol:	597.0057
ΔH_f, kcal/mol:	76.4
Dipole, Da:	2.55
IP(EA), eV:	-8.0(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z,2E)-N,N-diethyl-4-iodo-2-[iodo(trimethylsilyl)methylidene]-5-phenylmethoxypent-3-enamide

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)NC3=C2C=C(C=C3)/C(=C\C4=CC=CC=C4)/C5=CC=CC=C5

DOS

IR

Vibrations