Geometry & MOs

Info

ID:	203904
PubChem CID:	79890156
Reduced:	ON3H13C14 (1)
Stoich.:	AB3C13D14 (1)
Weight, g/mol:	271.11209
ΔH_f, kcal/mol:	38.32
Dipole, Da:	2.82
IP(EA), eV:	-8.14(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-[2-(2-fluorophenyl)ethyl]-1,3-benzoxazole-2,4-diamine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CNC2=NC3=C(O2)C=C(C=C3)N

DOS

IR

Vibrations