Geometry & MOs

Info

ID:	48047
PubChem CID:	10536775
Reduced:	FSO4H7C8 (1)
Stoich.:	ABC4D7E8 (1)
Weight, g/mol:	218.069142
ΔH_f, kcal/mol:	-188.5
Dipole, Da:	4.64
IP(EA), eV:	-9.53(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methoxy-2-[(E)-2-nitroethenyl]-1H-indole

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1C(=O)O)S(=O)O)F

DOS

IR

Vibrations