Geometry & MOs

Info

ID:	293979
PubChem CID:	117420724
Reduced:	ClN2O2C13H15 (1)
Stoich.:	AB2C2D13E15 (1)
Weight, g/mol:	266.082205
ΔH_f, kcal/mol:	-19.52
Dipole, Da:	2.31
IP(EA), eV:	-8.79(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-chloro-5-methoxy-4-propan-2-ylphenyl)-1,2-oxazol-5-amine

Drug info:

PubChemData

Smile

CC(C)C1=C(C(=CC(=C1)C2=NOC(=C2)N)Cl)OC

DOS

IR

Vibrations