Geometry & MOs

Info

ID:	440285
PubChem CID:	135230232
Reduced:	ClOSF3N3C11H17 (1)
Stoich.:	ABCD3E3F11G17 (1)
Weight, g/mol:	255.158292
ΔH_f, kcal/mol:	-196.68
Dipole, Da:	7.22
IP(EA), eV:	-8.49(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2S)-2-formamido-3,3-dimethylbutanoyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CCN(C(=O)CCSCCC(F)(F)F)/C(=C(/N)\Cl)/C=N

DOS

IR

Vibrations