Geometry & MOs

Info

ID:	376715
PubChem CID:	134222740
Reduced:	NO2F3C19H24 (1)
Stoich.:	AB2C3D19E24 (1)
Weight, g/mol:	489.214921
ΔH_f, kcal/mol:	-215.12
Dipole, Da:	2.42
IP(EA), eV:	-9.17(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-tert-butyl-2-[(1-tert-butyl-7-methoxyindolizin-6-yl)methyl]-6,7-difluoro-3,4-dihydro-2H-thiochromene 1,1-dioxide

Drug info:

PubChemData

Smile

CC(CC1C2C1(CNC2)C(C)(C)C)C3=CC4=C(C=C3F)OC(O4)(F)F

DOS

IR

Vibrations