Geometry & MOs

Info

ID:	273101
PubChem CID:	103770493
Reduced:	F2N2O2C9H12 (1)
Stoich.:	A2B2C2D9E12 (1)
Weight, g/mol:	286.079884
ΔH_f, kcal/mol:	-170.89
Dipole, Da:	3.86
IP(EA), eV:	-9.4(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,3-difluoro-2-hydroxypropyl)-1-methylsulfonylpyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CN1C=CC=C1C(=O)NCC(C(F)F)O

DOS

IR

Vibrations