Geometry & MOs

Info

ID:

298760

PubChem CID:

117655956

Reduced:

NO4C8H15 (2)

Stoich.:

AB4C8D15 (2)

Weight, g/mol:

473.14863

ΔHf, kcal/mol:

-414.08

Dipole, Da:

2.99

IP(EA), eV:

 -10.05(0.52)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[6-[[6-[(3R,6R)-5-amino-3,6-dimethyl-6-(trifluoromethyl)-2H-1,4-oxazin-3-yl]-5-fluoropyridin-2-yl]carbamoyl]-5-methylpyridin-3-yl]methyl hypofluorite

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCC1[C@H]([C@@H](C([C@H](O1)O)NC(=O)OC(C)(C)C)O)O

DOS

IR

Vibrations