Geometry & MOs

Info

ID:	164319
PubChem CID:	74382861
Reduced:	ClN2O4C23H39 (1)
Stoich.:	AB2C4D23E39 (1)
Weight, g/mol:	652.394787
ΔH_f, kcal/mol:	-215.04
Dipole, Da:	2.72
IP(EA), eV:	-8.29(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl-[2-methyl-5-[8-(4-phenylmethoxybutyl)-1,7-dioxaspiro[5.5]undecan-2-yl]pent-3-ynoxy]-diphenylsilane

Drug info:

PubChemData

Smile

CCC(C)OC1=C(C=C(C=C1)C(=O)N(C2CCCNC2)C(C)C)OCCCOC.Cl

DOS

IR

Vibrations