Geometry & MOs

Info

ID:

9092

PubChem CID:

85932

Reduced:

ON2C9H18 (1)

Stoich.:

AB2C9D18 (1)

Weight, g/mol:

170.141913

ΔHf, kcal/mol:

-77.32

Dipole, Da:

5.63

IP(EA), eV:

-9.39(1.51)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

5,5-dimethyl-4-propan-2-yl-1,3-diazinan-2-one

Drug info:

PubChemData

Smile

CC(C)C1C(CNC(=O)N1)(C)C

DOS

IR

Vibrations