Geometry & MOs

Info

ID:	344959
PubChem CID:	127268719
Reduced:	NSO2C13H23 (1)
Stoich.:	ABC2D13E23 (1)
Weight, g/mol:	273.063506
ΔH_f, kcal/mol:	-104.89
Dipole, Da:	4.01
IP(EA), eV:	-9.48(0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,3-difluorophenyl)sulfonyl-2-azabicyclo[2.2.1]heptane

Drug info:

PubChemData

Smile

C1CCC(CC1)CS(=O)(=O)N2CC3CCC2C3

DOS

IR

Vibrations