Geometry & MOs

Info

ID:

317924

PubChem CID:

126647732

Reduced:

NPC9H17 (1)

Stoich.:

ABC9D17 (1)

Weight, g/mol:

605.62831

ΔHf, kcal/mol:

17.4

Dipole, Da:

2.78

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.755906

Charge, e:

 -2

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1C2C1C(NC2)C=[P+](C)C

DOS

IR

Vibrations