Geometry & MOs

Info

ID:	57821
PubChem CID:	24277569
Reduced:	OSN3C14H15 (1)
Stoich.:	ABC3D14E15 (1)
Weight, g/mol:	190.146999
ΔH_f, kcal/mol:	-4.19
Dipole, Da:	4.78
IP(EA), eV:	-8.56(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-ethyl-2,3-dihydroindol-5-yl)ethanamine

Drug info:

PubChemData

Smile

CC1=C(N=C(S1)N)C2=CC3=C(C=C2)NC(=O)CCC3

DOS

IR

Vibrations