Geometry & MOs

Info

ID:

380139

PubChem CID:

134965124

Reduced:

C13H18 (1)

Stoich.:

A13B18 (1)

Weight, g/mol:

246.100442

ΔHf, kcal/mol:

-2.45

Dipole, Da:

0.44

IP(EA), eV:

-8.82(0.57)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-(2-morpholin-4-yl-1,3-benzoxazol-5-yl)ethanone

Drug info:

PubChemData

Smile

CCC(=C(C)C)C1=CC=C(C=C1)C

DOS

IR

Vibrations