Geometry & MOs

Info

ID:	395396
PubChem CID:	135025366
Reduced:	O5H18C20 (1)
Stoich.:	A5B18C20 (1)
Weight, g/mol:	565.246438
ΔH_f, kcal/mol:	-168.93
Dipole, Da:	3.91
IP(EA), eV:	-8.84(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl N-[(1R,2R,3R,4R,5R)-3,4-bis(phenylmethoxy)-5-(phenylmethoxymethyl)-6-oxabicyclo[3.1.0]hexan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC1(CCC2=C(O1)C=C3C(=C2O)C(=O)C(=C(O3)C4=CC=CC=C4)O)C

DOS

IR

Vibrations