Geometry & MOs

Info

ID:	398683
PubChem CID:	135034802
Reduced:	SN2O4C19H30 (1)
Stoich.:	AB2C4D19E30 (1)
Weight, g/mol:	515.265584
ΔH_f, kcal/mol:	-211.26
Dipole, Da:	2.24
IP(EA), eV:	-8.46(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(7S)-5'-[tert-butyl(dimethyl)silyl]oxy-3-fluoro-4',4'-dimethyl-2-naphthalen-2-ylspiro[8H-quinoline-7,2'-cyclohexane]-1'-one

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCC(C1=CC=C(C=C1)SC)NC(=O)OC(C)(C)C

DOS

IR

Vibrations