Geometry & MOs

Info

ID:	149781
PubChem CID:	53789457
Reduced:	ON5C26H27 (1)
Stoich.:	AB5C26D27 (1)
Weight, g/mol:	380.10324
ΔH_f, kcal/mol:	61.02
Dipole, Da:	4.77
IP(EA), eV:	-7.81(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(1-butylcyclopentyl)-3-iodoprop-2-enoxy]-trimethylsilane

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C32)NC4=CC=C(C=C4)N5CCCCC5

DOS

IR

Vibrations