Geometry & MOs

Info

ID:

235928

PubChem CID:

92711067

Reduced:

NOH5C6 (4)

Stoich.:

ABC5D6 (4)

Weight, g/mol:

398.174276

ΔHf, kcal/mol:

-25.95

Dipole, Da:

0.42

IP(EA), eV:

-8.4(-1.07)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-(2-phenylethyl)-3-[(R)-phenyl-(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]urea

Drug info:

PubChemData

Smile

C1COC2=C(O1)C=CC(=C2)NC(=O)N[C@@H](C3=CC=CC=C3)C4=NN=C(O4)C5=CC=CC=C5

DOS

IR

Vibrations