Geometry & MOs

Info

ID:

354534

PubChem CID:

127287148

Reduced:

O2N5C12H21 (1)

Stoich.:

A2B5C12D21 (1)

Weight, g/mol:

283.16444

ΔHf, kcal/mol:

-13.98

Dipole, Da:

3.9

IP(EA), eV:

-8.8(-0.49)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-methyl-3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-1-(2-morpholin-4-ylethyl)urea

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CNC(=O)NCC(C)N(C)C2CC2

DOS

IR

Vibrations