Geometry & MOs

Info

ID:	438502
PubChem CID:	135228244
Reduced:	NO2C13H17 (1)
Stoich.:	AB2C13D17 (1)
Weight, g/mol:	191.094629
ΔH_f, kcal/mol:	-56.7
Dipole, Da:	2.15
IP(EA), eV:	-8.75(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)C1=N[C@H](CO1)C2=CC=C(C=C2)OC

DOS

IR

Vibrations