Geometry & MOs

Info

ID:	248317
PubChem CID:	103080586
Reduced:	N3O4C14H15 (1)
Stoich.:	A3B4C14D15 (1)
Weight, g/mol:	266.029205
ΔH_f, kcal/mol:	-40.35
Dipole, Da:	10.26
IP(EA), eV:	-9.24(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-(6-fluoropyridin-3-yl)butane-1-sulfonamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CC(C2=NN(C=C2[N+](=O)[O-])C)C(=O)O

DOS

IR

Vibrations