Geometry & MOs

Info

ID:	401976
PubChem CID:	135053660
Reduced:	NO5C19H21 (1)
Stoich.:	AB5C19D21 (1)
Weight, g/mol:	544.293847
ΔH_f, kcal/mol:	-192.73
Dipole, Da:	3.32
IP(EA), eV:	-9.4(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3,11,11-tetramethyl-10-(1-tributylstannylethenyl)-1,5-dioxaspiro[5.5]undecan-10-ol

Drug info:

PubChemData

Smile

CC(=O)O[C@@H]1[C@H]2C(=CC3=CC=CC=C3)CCCN2C(=O)[C@H]1OC(=O)C

DOS

IR

Vibrations