Geometry & MOs

Info

ID:	25585
PubChem CID:	626974
Reduced:	OSF3N3H8C12 (1)
Stoich.:	ABC3D3E8F12 (1)
Weight, g/mol:	314.151809
ΔH_f, kcal/mol:	-141.67
Dipole, Da:	7.46
IP(EA), eV:	-8.95(-1.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-methoxy-2,2,8,8-tetramethylpyrano[3,2-g]chromen-10-yl)ethanone

Drug info:

PubChemData

Smile

CC1=CC(=C2C3=C(C(=O)N=C(N3)C)SC2=N1)C(F)(F)F

DOS

IR

Vibrations