Geometry & MOs

Info

ID:

379064

PubChem CID:

134352207

Reduced:

FNO3C15H16 (2)

Stoich.:

ABC3D15E16 (2)

Weight, g/mol:

534.244247

ΔHf, kcal/mol:

-304.57

Dipole, Da:

9.44

IP(EA), eV:

 -9.46(-1.35)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methyl N-[(2S)-1-[6-[5-(9,9-difluoro-7-methylfluoren-2-yl)-1H-imidazol-2-yl]-5-azaspiro[2.4]heptan-5-yl]-3-methyl-1-oxobutan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)C3=C(C2(F)F)C=C(C=C3)C(=O)COC(=O)[C@@H]4CC5(CC5)CN4C(=O)[C@H](C(C)C)NC(=O)OC

DOS

IR

Vibrations