Geometry & MOs

Info

ID:

169311

PubChem CID:

75088660

Reduced:

NPO10C29H42 (1)

Stoich.:

ABC10D29E42 (1)

Weight, g/mol:

98.084398

ΔHf, kcal/mol:

-501.95

Dipole, Da:

3.1

IP(EA), eV:

-9.17(0.06)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

4-methylidene-1,3-diazinane

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)C(COP(=O)(O)OCC(COCC1=CC=CC=C1)OCC2=CC=CC=C2)NC(=O)OC(C)(C)C

DOS

IR

Vibrations