Geometry & MOs

Info

ID:

189085

PubChem CID:

77814316

Reduced:

OF3N3C19H20 (1)

Stoich.:

AB3C3D19E20 (1)

Weight, g/mol:

622.182081

ΔHf, kcal/mol:

-141.99

Dipole, Da:

7.11

IP(EA), eV:

 -9.14(-0.64)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-N-[1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-8-N-[[4-(methylideneamino)-3-methylsulfanylphenyl]methyl]-2-thiophen-3-ylimidazo[1,2-a]pyridine-3,8-dicarboxamide

Drug info:

PubChemData

Smile

CC1C(NNC1C2=CC=C(C=C2)C(F)(F)F)C3=CC=C(C=C3)C(=O)NC

DOS

IR

Vibrations