Geometry & MOs

Info

ID:	219741
PubChem CID:	85164723
Reduced:	NS2O5C32H35 (1)
Stoich.:	AB2C5D32E35 (1)
Weight, g/mol:	578.283969
ΔH_f, kcal/mol:	-125.23
Dipole, Da:	5.46
IP(EA), eV:	-8.82(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,5-bis[methoxy(diphenyl)methyl]-2-[2-(methoxymethoxymethyl)cyclopropyl]-1,3,2-dioxaborolane

Drug info:

PubChemData

Smile

CC(=CC1CC(CN1C(=O)OCC=C)SC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)COS(=O)(=O)C

DOS

IR

Vibrations