Geometry & MOs

Info

ID:

445214

PubChem CID:

135265043

Reduced:

N3O5C41H45 (1)

Stoich.:

A3B5C41D45 (1)

Weight, g/mol:

702.341735

ΔHf, kcal/mol:

-65.61

Dipole, Da:

7.47

IP(EA), eV:

 -8.61(-0.51)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

tert-butyl 3-[5-[2,4-bis(phenylmethoxy)-5-propan-2-ylphenyl]-3-(ethylcarbamoyl)-1,2-oxazol-4-yl]-7,8-dihydro-5H-1,6-naphthyridine-6-carboxylate

Drug info:

PubChemData

Smile

CCNC(=O)C1=C(C(=NO1)C2=CC(=C(C=C2OCC3=CC=CC=C3)OCC4=CC=CC=C4)C(C)C)C5=CC6=C(CN(CC6)CCOC)C=C5

DOS

IR

Vibrations