Geometry & MOs

Info

ID:	243072
PubChem CID:	99215399
Reduced:	SF2N2O4H12C15 (1)
Stoich.:	AB2C2D4E12F15 (1)
Weight, g/mol:	351.139448
ΔH_f, kcal/mol:	-187.7
Dipole, Da:	5.73
IP(EA), eV:	-9.36(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-2-oxoethyl]-3,5-difluorobenzamide

Drug info:

PubChemData

Smile

CN(C1=C(C=CC=C1F)F)S(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3

DOS

IR

Vibrations