Geometry & MOs

Info

ID:

162958

PubChem CID:

57581034

Reduced:

NPC4H9 (1)

Stoich.:

ABC4D9 (1)

Weight, g/mol:

262.1235

ΔHf, kcal/mol:

17.05

Dipole, Da:

2.6

IP(EA), eV:

0.0(0.0)

Spin(Sz, S2):

0.500000, 0.754968

Charge, e:

0

Chem-info

IUPAC name:

[3-(3,4-dimethylphenyl)-1-oxa-2,7-diazaspiro[4.4]non-2-en-7-yl]phosphane

Drug info:

PubChemData

Smile

C1CN(C[CH]1)P

DOS

IR

Vibrations