Geometry & MOs

Info

ID:

387067

PubChem CID:

134983835

Reduced:

FeNPC13H17 (1)

Stoich.:

ABCD13E17 (1)

Weight, g/mol:

84.054624

ΔHf, kcal/mol:

69.33

Dipole, Da:

2.63

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.957108

Charge, e:

 0

Chem-info

IUPAC name:

(1R,2S)-1-azido-2-deuteriocyclopropane

Drug info:

PubChemData

Smile

CC(C)N(CCC#CC1=CC=CC=C1)P=[Fe]

DOS

IR

Vibrations