Geometry & MOs

Info

ID:	208467
PubChem CID:	80532714
Reduced:	SBr2O3C14H16 (1)
Stoich.:	AB2C3D14E16 (1)
Weight, g/mol:	385.89293
ΔH_f, kcal/mol:	-113.27
Dipole, Da:	3.86
IP(EA), eV:	-9.59(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-5-[bromo-(1-ethylcyclopentyl)methyl]-3-chlorothiophene

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations