Geometry & MOs

Info

ID:	310496
PubChem CID:	126580870
Reduced:	NS2O3H7C8 (1)
Stoich.:	AB2C3D7E8 (1)
Weight, g/mol:	364.080553
ΔH_f, kcal/mol:	-32.77
Dipole, Da:	6.67
IP(EA), eV:	-9.48(-2.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2,2-difluoro-7-methyl-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-5-ethylsulfanylpyridin-2-amine

Drug info:

PubChemData

Smile

CSSC1=CC(=C(C=C1)N=O)C(=O)O

DOS

IR

Vibrations