Geometry & MOs

Info

ID:	82415
PubChem CID:	49856006
Reduced:	FON2H7C9 (1)
Stoich.:	ABC2D7E9 (1)
Weight, g/mol:	220.137577
ΔH_f, kcal/mol:	9.09
Dipole, Da:	3.21
IP(EA), eV:	-9.39(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-N-[(5-fluoro-1H-indol-3-yl)methyl]ethanamine

Drug info:

PubChemData

Smile

C1=CC2=C(C=C1F)/C(=C/NO)/C=N2

DOS

IR

Vibrations