Geometry & MOs

Info

ID:

422241

PubChem CID:

135117480

Reduced:

FON5C15H18 (1)

Stoich.:

ABC5D15E18 (1)

Weight, g/mol:

552.269633

ΔHf, kcal/mol:

-25.69

Dipole, Da:

5.37

IP(EA), eV:

 -8.91(-0.34)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(11R)-15-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]-20-methoxy-11-propan-2-yl-18-oxa-3,6,9,12,15-pentazatricyclo[17.3.1.02,6]tricosa-1(23),2,4,19,21-pentaene-10,13-dione

Drug info:

PubChemData

Smile

CC1=C2CCCC2=NC(=N1)CCNC3=NC=C(C(=N3)OC)F

DOS

IR

Vibrations