Geometry & MOs

Info

ID:	57732
PubChem CID:	24276866
Reduced:	SN2C13H18 (1)
Stoich.:	AB2C13D18 (1)
Weight, g/mol:	238.093998
ΔH_f, kcal/mol:	21.71
Dipole, Da:	4.05
IP(EA), eV:	-8.54(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-fluorophenyl)-2-pyrrolidin-1-ylethanethioamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C(C(=S)N)N2CCCC2

DOS

IR

Vibrations