Geometry & MOs

Info

ID:	272140
PubChem CID:	103727364
Reduced:	BrN2O2C10H13 (1)
Stoich.:	AB2C2D10E13 (1)
Weight, g/mol:	288.129634
ΔH_f, kcal/mol:	-71.86
Dipole, Da:	3.36
IP(EA), eV:	-9.24(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-ethylsulfanylcyclopentyl)-1H-indole-5-carboxamide

Drug info:

PubChemData

Smile

CC1(CCN(C1)C(=O)C2=CC(=CN2)Br)O

DOS

IR

Vibrations