Geometry & MOs

Info

ID:	58949
PubChem CID:	24723458
Reduced:	SO3C14H18 (1)
Stoich.:	AB3C14D18 (1)
Weight, g/mol:	294.011743
ΔH_f, kcal/mol:	-111.32
Dipole, Da:	2.98
IP(EA), eV:	-9.34(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-chlorophenyl)-[5-(1,3-dioxolan-2-yl)thiophen-2-yl]methanone

Drug info:

PubChemData

Smile

C1CCC(CC1)C(=O)C2=CC=C(S2)C3OCCO3

DOS

IR

Vibrations