Geometry & MOs

Info

ID:

446453

PubChem CID:

135275087

Reduced:

N4C19H40 (1)

Stoich.:

A4B19C40 (1)

Weight, g/mol:

578.225323

ΔHf, kcal/mol:

-53.53

Dipole, Da:

1.41

IP(EA), eV:

 -8.41(2.65)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-[10-[4-(hydroxymethyl)piperidine-1-carbonyl]-6-(trifluoromethyl)-1,10-diazatricyclo[6.4.1.04,13]trideca-2,4,6,8(13)-tetraen-3-yl]-3-imidazo[1,2-a]pyridin-3-yl-1,2-dihydropyrrol-5-one

Drug info:

PubChemData

Smile

CC(C)(C)N1CCC(CC1)NCCC(C)(C)N2CCC(CC2)N

DOS

IR

Vibrations