Geometry & MOs

Info

ID:	410871
PubChem CID:	135083672
Reduced:	NSO3C12H15 (1)
Stoich.:	ABC3D12E15 (1)
Weight, g/mol:	215.131014
ΔH_f, kcal/mol:	-66.73
Dipole, Da:	6.17
IP(EA), eV:	-9.72(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,5-dimethyl-2-(prop-2-enoxymethyl)indole

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N(C)CC#CCO

DOS

IR

Vibrations