Geometry & MOs

Info

ID:	265566
PubChem CID:	103530117
Reduced:	ClN2O3C13H17 (1)
Stoich.:	AB2C3D13E17 (1)
Weight, g/mol:	288.094392
ΔH_f, kcal/mol:	-108.7
Dipole, Da:	5.28
IP(EA), eV:	-8.74(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-5-(3-methoxypyrrolidin-1-yl)sulfonyl-3-methylaniline

Drug info:

PubChemData

Smile

COC1CN(CC1OC)C(=O)C2=C(C(=CC=C2)N)Cl

DOS

IR

Vibrations