Geometry & MOs

Info

ID:	207210
PubChem CID:	80361875
Reduced:	NOH6C7 (2)
Stoich.:	ABC6D7 (2)
Weight, g/mol:	246.136828
ΔH_f, kcal/mol:	-1.56
Dipole, Da:	2.32
IP(EA), eV:	-8.21(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,4,5-trimethyloxolan-3-yl)-1,3-benzoxazol-4-amine

Drug info:

PubChemData

Smile

COC1=CC=CC=C1C2=NC3=C(C=CC=C3O2)N

DOS

IR

Vibrations