Geometry & MOs

Info

ID:

420559

PubChem CID:

135113919

Reduced:

OSN2C18H22 (1)

Stoich.:

ABC2D18E22 (1)

Weight, g/mol:

588.274798

ΔHf, kcal/mol:

0.67

Dipole, Da:

1.84

IP(EA), eV:

 -8.67(-0.22)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

7-fluoro-23-methoxy-15-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]-2-oxa-10,15,19-triazatricyclo[19.2.2.03,8]pentacosa-1(23),3(8),4,6,21,24-hexaene-11,20-dione

Drug info:

PubChemData

Smile

CC1=CN=C(C=C1)CN2CCC3(CC2)C4=C(CCO3)C=CS4

DOS

IR

Vibrations