Geometry & MOs

Info

ID:	149196
PubChem CID:	53788868
Reduced:	O2F4C23H32 (1)
Stoich.:	A2B4C23D32 (1)
Weight, g/mol:	264.077993
ΔH_f, kcal/mol:	-306.77
Dipole, Da:	5.06
IP(EA), eV:	-9.75(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[(3-methylsulfonyl-3,4-dihydro-2H-pyrrol-5-yl)amino]oxyacetate

Drug info:

PubChemData

Smile

COCCCC1CCC(CC1)C2CCC(CC2)C3=CC(=C(C(=C3)F)OC(F)F)F

DOS

IR

Vibrations