Geometry & MOs

Info

ID:	274418
PubChem CID:	103809171
Reduced:	SN2O2F3C7H13 (1)
Stoich.:	AB2C2D3E7F13 (1)
Weight, g/mol:	242.070069
ΔH_f, kcal/mol:	-251.9
Dipole, Da:	2.68
IP(EA), eV:	-9.72(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(trifluoromethylsulfanyl)ethyl]pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

C(COCC(=O)NCCSC(F)(F)F)N

DOS

IR

Vibrations