Geometry & MOs

Info

ID:	200274
PubChem CID:	79375792
Reduced:	OSN4C12H12 (1)
Stoich.:	ABC4D12E12 (1)
Weight, g/mol:	297.139865
ΔH_f, kcal/mol:	49.45
Dipole, Da:	4.24
IP(EA), eV:	-9.18(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methoxy-2-(3-methoxypropylsulfinyl)-N-methyl-2,3-dihydro-1H-inden-1-amine

Drug info:

PubChemData

Smile

CC1=NSC(=C1C#N)NCC2=CC(=NC=C2)OC

DOS

IR

Vibrations