Geometry & MOs

Info

ID:

356462

PubChem CID:

127291566

Reduced:

O2N5C21H23 (1)

Stoich.:

A2B5C21D23 (1)

Weight, g/mol:

370.157581

ΔHf, kcal/mol:

10.37

Dipole, Da:

4.44

IP(EA), eV:

 -8.72(-0.98)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(8lambda4-thia-7,9-diazabicyclo[4.3.0]nona-1(6),2,4,7,8-pentaen-2-yl)-2-(1-methyl-2-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)acetamide

Drug info:

PubChemData

Smile

CC(C)C1=NC2=C(N1C)CCN(C2)CC3=NC(=O)C4=C(N3)C5=CC=CC=C5O4

DOS

IR

Vibrations