Geometry & MOs

Info

ID:	46252
PubChem CID:	10523512
Reduced:	SO2N3H17C21 (1)
Stoich.:	AB2C3D17E21 (1)
Weight, g/mol:	375.0599
ΔH_f, kcal/mol:	40.62
Dipole, Da:	10.23
IP(EA), eV:	-8.7(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(benzenesulfonyl)-3-(ethylsulfinylmethyl)indole-2-carbaldehyde

Drug info:

PubChemData

Smile

C1CCC2=C(C1)C(=C3C(=NC(=S)OC3=N2)NC4=CC=CC=C4)C5=CC=CO5

DOS

IR

Vibrations