Geometry & MOs

Info

ID:	379664
PubChem CID:	134455397
Reduced:	ClSF2O3N6C23H23 (1)
Stoich.:	ABC2D3E6F23G23 (1)
Weight, g/mol:	499.269573
ΔH_f, kcal/mol:	-119.14
Dipole, Da:	6.98
IP(EA), eV:	-8.68(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-N-(2-methoxyphenyl)-2-methyl-5-N-[5-(3-oxa-9-azaspiro[5.5]undecan-9-yl)pyridin-2-yl]-1H-imidazo[4,5-b]pyridine-5,7-diamine

Drug info:

PubChemData

Smile

CN1C=CC(=N1)C2=CC(=C(C=C2)NC3=CC(=NC4=C3N=C(N4C5CCCCO5)C(F)F)Cl)S(=O)(=O)C

DOS

IR

Vibrations