Geometry & MOs

Info

ID:

375831

PubChem CID:

134221822

Reduced:

NO3C13H19 (2)

Stoich.:

AB3C13D19 (2)

Weight, g/mol:

579.218779

ΔHf, kcal/mol:

-276.21

Dipole, Da:

11.14

IP(EA), eV:

 -8.82(-1.11)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2S)-2-[1-(4-chloro-2-methylbenzoyl)-4-(8-fluoro-5-methyl-3,4-dihydro-2H-chromen-6-yl)-6-methyl-2,3-dihydroindol-5-yl]-2-[(2-methylpropan-2-yl)oxy]acetic acid

Drug info:

PubChemData

Smile

CCC(C)(CCNC(=O)C1=CC2=C(C=C(C=C2)N(CC)CC)OC1=O)OCCC(C)(C)C(=O)O

DOS

IR

Vibrations