Geometry & MOs

Info

ID:	314737
PubChem CID:	126622920
Reduced:	OF2N2C11H18 (1)
Stoich.:	AB2C2D11E18 (1)
Weight, g/mol:	268.115397
ΔH_f, kcal/mol:	-159.07
Dipole, Da:	0.97
IP(EA), eV:	-9.4(0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,4R)-4-fluoro-N-(3-fluoro-4-methylpent-3-en-2-yl)pyrrolidine-2-carboxamide;hydrochloride

Drug info:

PubChemData

Smile

C[C@H](C(=C(C)C)F)NC(=O)[C@@H]1C[C@H](CN1)F

DOS

IR

Vibrations