Geometry & MOs

Info

ID:	208482
PubChem CID:	80534583
Reduced:	NSBr2O3H7C14 (1)
Stoich.:	ABC2D3E7F14 (1)
Weight, g/mol:	371.80206
ΔH_f, kcal/mol:	4.72
Dipole, Da:	3.55
IP(EA), eV:	-9.06(-1.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dibromo-5-(1-chloro-3,3,3-trifluoropropyl)thiophene

Drug info:

PubChemData

Smile

C1OC2=C(O1)C=C(C=C2)C(C#N)C(=O)C3=CC(=C(S3)Br)Br

DOS

IR

Vibrations