Geometry & MOs

Info

ID:	180421
PubChem CID:	76630477
Reduced:	FS2N4O5C15H15 (1)
Stoich.:	AB2C4D5E15F15 (1)
Weight, g/mol:	572.187561
ΔH_f, kcal/mol:	-134.25
Dipole, Da:	2.69
IP(EA), eV:	-9.45(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-cyclopropylsulfonylphenyl)-N-[5-[methyl-[3-(methylamino)propyl]amino]-[1,3]thiazolo[5,4-b]pyridin-2-yl]-2-(oxolan-3-yloxyimino)acetamide

Drug info:

PubChemData

Smile

C1COCC1ON=C(C2=CC=C(C=C2)S(=O)(=O)N)C(=O)NC3=NC=C(S3)F

DOS

IR

Vibrations