Geometry & MOs

Info

ID:	42608
PubChem CID:	8149766
Reduced:	ClFSN3O3H17C18 (1)
Stoich.:	ABCD3E3F17G18 (1)
Weight, g/mol:	391.102
ΔH_f, kcal/mol:	-143.3
Dipole, Da:	4.28
IP(EA), eV:	-9.18(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4Z)-4-[[2-(difluoromethoxy)phenyl]methylidene]-2-(4-phenylphenyl)-1,3-oxazol-5-one

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)[C@H](C)NC3=CC(=C(C=C3)F)Cl)C

DOS

IR

Vibrations