Geometry & MOs

Info

ID:	172672
PubChem CID:	75539567
Reduced:	ClS2N3C5H8 (1)
Stoich.:	AB2C3D5E8 (1)
Weight, g/mol:	189.115364
ΔH_f, kcal/mol:	18.34
Dipole, Da:	5.1
IP(EA), eV:	-9.44(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-methylpropoxy)-1H-indole

Drug info:

PubChemData

Smile

C1=C(N=CS1)CSC(=N)N.Cl

DOS

IR

Vibrations