Geometry & MOs

Info

ID:	251078
PubChem CID:	103101307
Reduced:	OSN3C11H19 (1)
Stoich.:	ABC3D11E19 (1)
Weight, g/mol:	248.127326
ΔH_f, kcal/mol:	-26.23
Dipole, Da:	3.48
IP(EA), eV:	-8.87(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(6-amino-1,3-benzoxazol-2-yl)methyl-ethylamino]acetamide

Drug info:

PubChemData

Smile

CCN(CC(=O)N)C(C1=CSC=C1)C(C)N

DOS

IR

Vibrations