Geometry & MOs

Info

ID:	372602
PubChem CID:	131300682
Reduced:	NOF3C10H12 (1)
Stoich.:	ABC3D10E12 (1)
Weight, g/mol:	203.094629
ΔH_f, kcal/mol:	-184.03
Dipole, Da:	5.48
IP(EA), eV:	-9.24(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-methoxy-2-methyl-1H-indol-6-yl)ethanone

Drug info:

PubChemData

Smile

CC1=CC(=C(O1)C(F)(F)F)[C@H]2CCCN2

DOS

IR

Vibrations