Geometry & MOs

Info

ID:	221663
PubChem CID:	85285853
Reduced:	SiO6C33H56 (1)
Stoich.:	AB6C33D56 (1)
Weight, g/mol:	577.267567
ΔH_f, kcal/mol:	-334.22
Dipole, Da:	2.74
IP(EA), eV:	-8.8(0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl N-[5-[(7-hydroxy-2-phenyl-8-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl)oxy]pentyl]carbamate

Drug info:

PubChemData

Smile

CCC=CCC(C=CC(C1COC(O1)(C)C)C(CC=CCC=CCCC(=O)OC)C(=O)C)O[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations