Geometry & MOs

Info

ID:

190205

PubChem CID:

77967968

Reduced:

SN6O9C35H50 (1)

Stoich.:

AB6C9D35E50 (1)

Weight, g/mol:

482.269319

ΔHf, kcal/mol:

-382.66

Dipole, Da:

7.66

IP(EA), eV:

 -9.88(-0.84)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-cyclopropyl-N-[[4-fluoro-1-(3-hydroxypropyl)-2,3-dihydroindol-3-yl]methyl]-4-(1-methyl-2-oxopyridin-4-yl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CCC(C)S(=O)(=O)NC(=O)C12CC1C=CCCCCCC(C(=O)N3CC(CC3C(=O)N2)NC(=O)C4=CC=C(C=C4)C(=O)N)NC(=O)OC(C)(C)C

DOS

IR

Vibrations