Geometry & MOs

Info

ID:

442220

PubChem CID:

135250657

Reduced:

N5C14H19 (1)

Stoich.:

A5B14C19 (1)

Weight, g/mol:

604.308979

ΔHf, kcal/mol:

56.12

Dipole, Da:

3.05

IP(EA), eV:

-8.31(-0.05)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-[4-[3-[4-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]-5-(4-phenylphenyl)phenyl]phenyl]-4,4,5,5-tetramethyl-1,3-oxazole

Drug info:

PubChemData

Smile

C[C@]12CNCC1CCN(C2)C3=NC=NC4=C3C=CN4

DOS

IR

Vibrations