Geometry & MOs

Info

ID:

189097

PubChem CID:

77818008

Reduced:

O4N5C26H31 (1)

Stoich.:

A4B5C26D31 (1)

Weight, g/mol:

484.341341

ΔHf, kcal/mol:

-95.34

Dipole, Da:

2.43

IP(EA), eV:

 -8.85(-1.11)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

7-(2-amino-3,3-dimethylbutanoyl)-N-[4-amino-1-(2-methylidenecyclobutyl)-3-oxopent-4-en-2-yl]-10,10-dimethyl-7-azadispiro[3.0.45.14]decane-8-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)C1=CC=C(C=C1)N2CCN(C(C2)OC)C3=NC(=CC(=O)N3C)C4=CC=NC=C4

DOS

IR

Vibrations