Geometry & MOs

Info

ID:

437139

PubChem CID:

135215173

Reduced:

O5N7C28H55 (1)

Stoich.:

A5B7C28D55 (1)

Weight, g/mol:

440.133634

ΔHf, kcal/mol:

-285.33

Dipole, Da:

7.95

IP(EA), eV:

 -9.07(0.09)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-(6-aminopyridin-3-yl)-1-[(1R,8S)-12-(2,4-difluorophenyl)-15-oxatetracyclo[6.6.1.02,7.09,14]pentadeca-2(7),3,5,9(14),10,12-hexaen-4-yl]ethanone

Drug info:

PubChemData

Smile

CCCN(CCC)CCNC(=O)CCNC(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)C(CC(C)C)NC(=O)CNC

DOS

IR

Vibrations