Geometry & MOs

Info

ID:	27514
PubChem CID:	821759
Reduced:	SO2N3C12H13 (1)
Stoich.:	AB2C3D12E13 (1)
Weight, g/mol:	275.999924
ΔH_f, kcal/mol:	-17.72
Dipole, Da:	3.3
IP(EA), eV:	-8.37(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-N-[(1R)-2,2,2-trichloro-1-pyrrolidin-1-ylethyl]acetamide

Drug info:

PubChemData

Smile

COC(=O)C1=C(N(N=C1SC)C2=CC=CC=C2)N

DOS

IR

Vibrations