Geometry & MOs

Info

ID:	203918
PubChem CID:	79891050
Reduced:	O2N3C13H19 (1)
Stoich.:	A2B3C13D19 (1)
Weight, g/mol:	221.116427
ΔH_f, kcal/mol:	-45.65
Dipole, Da:	3.48
IP(EA), eV:	-8.21(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(5-amino-1,3-benzoxazol-2-yl)amino]-2-methylpropan-2-ol

Drug info:

PubChemData

Smile

CC(C)C(COC)NC1=NC2=C(O1)C=CC(=C2)N

DOS

IR

Vibrations