Geometry & MOs

Info

ID:	290062
PubChem CID:	104405136
Reduced:	ON4C14H22 (1)
Stoich.:	AB4C14D22 (1)
Weight, g/mol:	290.13789
ΔH_f, kcal/mol:	-36.33
Dipole, Da:	3.57
IP(EA), eV:	-8.02(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(6-amino-1,3-benzoxazol-2-yl)amino]-1-morpholin-4-ylpropan-1-one

Drug info:

PubChemData

Smile

CC1=CC(=CN=C1NC(C)C(=O)N2CCCCC2)N

DOS

IR

Vibrations