Geometry & MOs

Info

ID:	285038
PubChem CID:	104092567
Reduced:	NO3C14H17 (1)
Stoich.:	AB3C14D17 (1)
Weight, g/mol:	281.027728
ΔH_f, kcal/mol:	-39.39
Dipole, Da:	1.7
IP(EA), eV:	-8.29(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-pent-4-ynylindole-3-sulfonyl chloride

Drug info:

PubChemData

Smile

C#CCCCOC1=CC2=C(C=C1CCN)OCO2

DOS

IR

Vibrations