Geometry & MOs

Info

ID:

186715

PubChem CID:

77472075

Reduced:

OF3N3C12H14 (1)

Stoich.:

AB3C3D12E14 (1)

Weight, g/mol:

810.31503

ΔHf, kcal/mol:

-173.57

Dipole, Da:

9.95

IP(EA), eV:

 -9.64(-1.29)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[4-[(5-chloro-1H-indole-2-carbonyl)amino]-1-[5-[hydroxy(diphenyl)silyl]-2,2,5-trimethylhexanoyl]piperidin-3-yl]-5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1CC(=O)N(C1)C2=CN=C(N=C2)C(F)(F)F

DOS

IR

Vibrations