Geometry & MOs

Info

ID:	438527
PubChem CID:	135228269
Reduced:	FNOSH8C9 (1)
Stoich.:	ABCDE8F9 (1)
Weight, g/mol:	191.094629
ΔH_f, kcal/mol:	-49.8
Dipole, Da:	6.22
IP(EA), eV:	-8.88(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-4-(4-methoxyphenyl)-2-methyl-4,5-dihydro-1,3-oxazole

Drug info:

PubChemData

Smile

C1C(NC(=S)O1)C2=CC=CC=C2F

DOS

IR

Vibrations