Geometry & MOs

Info

ID:

51809

PubChem CID:

12014559

Reduced:

NOH7C8 (4)

Stoich.:

ABC7D8 (4)

Weight, g/mol:

564.200885

ΔHf, kcal/mol:

-19.53

Dipole, Da:

7.65

IP(EA), eV:

 -8.87(-0.62)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(4S,10'bR)-3-anilino-6,9'-dimethoxy-10'b-methyl-3'-phenylspiro[1,3-benzoxazine-4,2'-1H-pyrazolo[1,5-c][1,3]benzoxazine]-2,5'-dione

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NN2C(=O)OC3=CC=CC=C3[C@@]24C[C@@]5(C6=CC=CC=C6OC(=O)N5N4C7=CC=C(C=C7)C)C

DOS

IR

Vibrations