Geometry & MOs

Info

ID:	342168
PubChem CID:	127264881
Reduced:	SN3O5C14H15 (1)
Stoich.:	AB3C5D14E15 (1)
Weight, g/mol:	273.077677
ΔH_f, kcal/mol:	-157.01
Dipole, Da:	3.87
IP(EA), eV:	-8.82(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-azabicyclo[4.1.0]heptan-2-yl-(2,3,4,5-tetrafluorophenyl)methanone

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NC(=O)CS(=O)(=O)C2=NC=C(N2)C(=O)OC

DOS

IR

Vibrations