Geometry & MOs

Info

ID:	289687
PubChem CID:	104367158
Reduced:	ClSO2H11C13 (1)
Stoich.:	ABC2D11E13 (1)
Weight, g/mol:	271.946556
ΔH_f, kcal/mol:	-28.55
Dipole, Da:	3.21
IP(EA), eV:	-9.32(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3,5-dichlorophenoxy)thiophene-2-carbaldehyde

Drug info:

PubChemData

Smile

CCC1=C(C=CC(=C1)OC2=CC=C(S2)C=O)Cl

DOS

IR

Vibrations