Geometry & MOs

Info

ID:	29177
PubChem CID:	832175
Reduced:	N2O2F3C16H19 (1)
Stoich.:	A2B2C3D16E19 (1)
Weight, g/mol:	286.164105
ΔH_f, kcal/mol:	-220.1
Dipole, Da:	5.13
IP(EA), eV:	-9.64(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3aS,6aS)-3,6-bis(hydroxymethyl)-1,4-dipropyl-3a,6a-dihydroimidazo[4,5-d]imidazole-2,5-dione

Drug info:

PubChemData

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CC(C)CC1=NN([C@@](C1)(C(F)(F)F)O)C(=O)CC2=CC=CC=C2

DOS

IR

Vibrations