Geometry & MOs

Info

ID:

406443

PubChem CID:

135077655

Reduced:

N4O5C40H44 (1)

Stoich.:

A4B5C40D44 (1)

Weight, g/mol:

352.142307

ΔHf, kcal/mol:

-130.49

Dipole, Da:

6.21

IP(EA), eV:

-9.42(-0.35)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

benzyl N-[(1S)-1-(4-benzyl-5-oxo-4H-1,3-oxazol-2-yl)ethyl]carbamate

Drug info:

PubChemData

Smile

C[C@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)OC(C)(C)C)NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)CN=C(C3=CC=CC=C3)C4=CC=CC=C4

DOS

IR

Vibrations