Geometry & MOs

Info

ID:

168134

PubChem CID:

74928338

Reduced:

F3O4N5C23H40 (1)

Stoich.:

A3B4C5D23E40 (1)

Weight, g/mol:

565.345104

ΔHf, kcal/mol:

-383.16

Dipole, Da:

1.79

IP(EA), eV:

 -9.45(0.44)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

tert-butyl N-[1-[2-[[2-[[1-(dimethylamino)-4-methyl-1-oxopentan-2-yl]amino]-3,3,3-trifluoropropyl]carbamoyl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C)CC(C(=O)N(C)C)NC(CNC(=O)C1CCCN1C(=O)C(C(C)C)NC(=O)C)C(F)(F)F

DOS

IR

Vibrations