Geometry & MOs

Info

ID:	207207
PubChem CID:	80361662
Reduced:	ON2F3H9C14 (1)
Stoich.:	AB2C3D9E14 (1)
Weight, g/mol:	204.089878
ΔH_f, kcal/mol:	-126.4
Dipole, Da:	4.51
IP(EA), eV:	-8.6(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(oxolan-3-yl)-1,3-benzoxazol-4-amine

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)C(F)(F)F)C2=NC3=C(C=CC=C3O2)N

DOS

IR

Vibrations