Geometry & MOs

Info

ID:	43684
PubChem CID:	10321644
Reduced:	N2O2C29H44 (1)
Stoich.:	A2B2C29D44 (1)
Weight, g/mol:	452.274672
ΔH_f, kcal/mol:	-99.87
Dipole, Da:	3.11
IP(EA), eV:	-8.93(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl-[[(2S,3S,6R,11R)-3,11-dimethyl-1,7-dioxaspiro[5.5]undecan-2-yl]methoxy]-diphenylsilane

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCOC1=CC=CC(=C1)CN(CC2=CC=CC=N2)C(=O)C

DOS

IR

Vibrations