Geometry & MOs

Info

ID:	68322
PubChem CID:	46508187
Reduced:	SN4O5C20H22 (1)
Stoich.:	AB4C5D20E22 (1)
Weight, g/mol:	378.064983
ΔH_f, kcal/mol:	-179.09
Dipole, Da:	3.64
IP(EA), eV:	-8.52(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5-difluorophenyl)-2-[[5-(4-fluorophenyl)-1,3-oxazol-2-yl]sulfanyl]propanamide

Drug info:

PubChemData

Smile

C1CC2=C(C1)SC(=C2C(=O)N)NC(=O)COC(=O)CC(C3=CC=CC=C3)NC(=O)N

DOS

IR

Vibrations