Geometry & MOs

Info

ID:	320141
PubChem CID:	126658464
Reduced:	NSF3O7C19H28 (1)
Stoich.:	ABC3D7E19F28 (1)
Weight, g/mol:	290.13068
ΔH_f, kcal/mol:	-493.16
Dipole, Da:	2.15
IP(EA), eV:	-8.99(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methoxy-1-(7-methoxy-1H-inden-4-yl)-1H-indene

Drug info:

PubChemData

Smile

CC(C(=O)OC12CC3CC(C1)CC(C3)(C2)C(=O)OC(CS(=O)(=O)O)C(F)(F)F)N(C)C

DOS

IR

Vibrations