Geometry & MOs

Info

ID:	244198
PubChem CID:	99319343
Reduced:	SF2N2O2H16C17 (1)
Stoich.:	AB2C2D2E16F17 (1)
Weight, g/mol:	408.164934
ΔH_f, kcal/mol:	-131.69
Dipole, Da:	3.59
IP(EA), eV:	-9.19(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-difluoro-N-[2-[[2-(2-phenylethyl)benzoyl]amino]ethyl]benzamide

Drug info:

PubChemData

Smile

C1CC2=C(C1)SC(=C2)C(=O)NCCNC(=O)C3=C(C=C(C=C3)F)F

DOS

IR

Vibrations