Geometry & MOs

Info

ID:

389260

PubChem CID:

134991888

Reduced:

N12O13C79H110 (1)

Stoich.:

A12B13C79D110 (1)

Weight, g/mol:

332.143968

ΔHf, kcal/mol:

-537.85

Dipole, Da:

4.45

IP(EA), eV:

 -9.09(-0.29)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCCCOC(=O)N[C@@H](CC1=CN=CN1C)C(=O)N[C@@H](C(C)OC(C)(C)C)C(=O)N[C@H](C(C)C)C(=O)N[C@@H](CC2=CN(C=N2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C(=O)N[C@H](CC6=CC=CC=C6)C(=O)N[C@H](C(C)C)C(=O)N[C@@H](C(C)OC(C)(C)C)C(=O)N[C@@H](C(C)CC)C(=O)OC

DOS

IR

Vibrations