Geometry & MOs

Info

ID:	68324
PubChem CID:	46508191
Reduced:	ClFSN2O3H16C19 (1)
Stoich.:	ABCD2E3F16G19 (1)
Weight, g/mol:	384.130777
ΔH_f, kcal/mol:	-96.09
Dipole, Da:	5.75
IP(EA), eV:	-8.4(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[5-(4-fluorophenyl)-1,3-oxazol-2-yl]sulfanyl]-N-(2-methyl-1-phenylpropyl)acetamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC(=C(C=C1)OC)Cl)SC2=NC=C(O2)C3=CC=C(C=C3)F

DOS

IR

Vibrations