Geometry & MOs

Info

ID:

49520

PubChem CID:

11533170

Reduced:

ON2C15H18 (2)

Stoich.:

AB2C15D18 (2)

Weight, g/mol:

484.341341

ΔHf, kcal/mol:

-82.34

Dipole, Da:

3.61

IP(EA), eV:

 -8.93(-0.82)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[3,3-dimethyl-2-[2-(2-methylpropylamino)propanoylamino]butanoyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=NC5=C(C=C4)C=CC(=N5)NC(=O)C67CC8CC(C6)CC(C8)C7

DOS

IR

Vibrations