Geometry & MOs

Info

ID:

354535

PubChem CID:

127287149

Reduced:

O3N5C12H21 (1)

Stoich.:

A3B5C12D21 (1)

Weight, g/mol:

295.200825

ΔHf, kcal/mol:

-64.25

Dipole, Da:

4.84

IP(EA), eV:

-8.76(-0.6)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-[(1-propan-2-ylpiperidin-3-yl)methyl]urea

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CNC(=O)N(C)CCN2CCOCC2

DOS

IR

Vibrations