Geometry & MOs

Info

ID:	26925
PubChem CID:	804403
Reduced:	ON3C17H19 (1)
Stoich.:	AB3C17D19 (1)
Weight, g/mol:	190.012222
ΔH_f, kcal/mol:	27.29
Dipole, Da:	10.64
IP(EA), eV:	-7.92(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(ethylsulfonylmethyl)thiophene

Drug info:

PubChemData

Smile

CC1=C2C(=NN=C(C2=C(N1C3=CC=CC=C3OC)C)C)C

DOS

IR

Vibrations