Geometry & MOs

Info

ID:	55057
PubChem CID:	17389710
Reduced:	NC19H23 (1)
Stoich.:	AB19C23 (1)
Weight, g/mol:	227.076871
ΔH_f, kcal/mol:	0.43
Dipole, Da:	2.14
IP(EA), eV:	-8.24(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,5-dimethylthiophen-3-yl)-1H-indole

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)NC(=C2)C34CC5CC(C3)CC(C5)C4

DOS

IR

Vibrations