Geometry & MOs

Info

ID:

50960

PubChem CID:

12013562

Reduced:

ON3C12H16 (2)

Stoich.:

AB3C12D16 (2)

Weight, g/mol:

1988.543831

ΔHf, kcal/mol:

-40.91

Dipole, Da:

2.3

IP(EA), eV:

 -9.11(-0.97)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1,3-bis(5,7-dipropyl-1,8-naphthyridin-2-yl)urea;1-(3,4,5-tridodecoxyphenyl)-3-[7-[(3,4,5-tridodecoxyphenyl)carbamoylamino]-1,8-naphthyridin-2-yl]urea

Drug info:

PubChemData

Smile

CCCCC(=O)NC1=NC2=C(C=CC=N2)C=C1.CCCCNC(=O)NC1=NC=CC(=C1)C

DOS

IR

Vibrations