Geometry & MOs

Info

ID:	273066
PubChem CID:	103770431
Reduced:	NSF2O2C13H17 (1)
Stoich.:	ABC2D2E13F17 (1)
Weight, g/mol:	298.94272
ΔH_f, kcal/mol:	-181.0
Dipole, Da:	5.73
IP(EA), eV:	-8.71(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-(3,3-difluoro-2-hydroxypropyl)thiophene-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)SCCCC(=O)NCC(C(F)F)O

DOS

IR

Vibrations