Geometry & MOs

Info

ID:

319659

PubChem CID:

126656946

Reduced:

NH26C41 (2)

Stoich.:

AB26C41 (2)

Weight, g/mol:

301.11365

ΔHf, kcal/mol:

356.08

Dipole, Da:

2.57

IP(EA), eV:

 -8.14(-1.1)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-methyl-3-[2-[2-[2-(3-methylfuran-2-yl)ethyl]thiophen-3-yl]ethyl]-1,2-oxazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=C3C=CC(=CC3=C(C4=CC=CC=C42)C5=CC=C(C=C5)C6=CC7=C(C=C6)N(C8=CC=CC=C87)C9=CC=CC=C9)C1=CC2=C(C3=CC=CC=C3C(=C2C=C1)C1=CC=CC=C1)C1=CC=C(C=C1)N1C2=CC=CC=C2C2=CC=CC=C21

DOS

IR

Vibrations