Geometry & MOs

Info

ID:	273085
PubChem CID:	103770465
Reduced:	SF2N2O3C8H12 (1)
Stoich.:	AB2C2D3E8F12 (1)
Weight, g/mol:	305.008884
ΔH_f, kcal/mol:	-235.7
Dipole, Da:	3.12
IP(EA), eV:	-9.43(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-(3,3-difluoro-2-hydroxypropyl)-1-benzothiophene-2-carboxamide

Drug info:

PubChemData

Smile

C1C(=O)N(CS1)CC(=O)NCC(C(F)F)O

DOS

IR

Vibrations