Geometry & MOs

Info

ID:	217374
PubChem CID:	85087715
Reduced:	NSiO4C18H35 (1)
Stoich.:	ABC4D18E35 (1)
Weight, g/mol:	358.141638
ΔH_f, kcal/mol:	-217.83
Dipole, Da:	5.39
IP(EA), eV:	-8.82(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 6-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-5-methoxy-3-methyl-2,3-dihydro-1H-indene-2-carboxylate

Drug info:

PubChemData

Smile

CC=CC(CC[N+](=CCCCOC(=O)C)[O-])O[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations