Geometry & MOs

Info

ID:

234409

PubChem CID:

92298364

Reduced:

NO3C4H8 (2)

Stoich.:

AB3C4D8 (2)

Weight, g/mol:

221.141579

ΔHf, kcal/mol:

-280.74

Dipole, Da:

3.61

IP(EA), eV:

-10.2(0.12)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(1S,2S)-1-(3,4-dihydro-2H-chromen-6-yl)-2-(methylamino)propan-1-ol

Drug info:

PubChemData

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DOS

IR

Vibrations