Geometry & MOs

Info

ID:	255549
PubChem CID:	103132889
Reduced:	NO2C17H27 (1)
Stoich.:	AB2C17D27 (1)
Weight, g/mol:	278.121927
ΔH_f, kcal/mol:	-93.02
Dipole, Da:	3.88
IP(EA), eV:	-8.59(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-[2,3-dihydro-1H-indol-7-yl(fluoro)methyl]isoquinoline

Drug info:

PubChemData

Smile

CCC(C1=CC=CC=C1OCC2CCC(O2)C)NCC

DOS

IR

Vibrations