Geometry & MOs

Info

ID:	221618
PubChem CID:	85285723
Reduced:	SN4O9C25H28 (1)
Stoich.:	AB4C9D25E28 (1)
Weight, g/mol:	562.231516
ΔH_f, kcal/mol:	-200.77
Dipole, Da:	11.27
IP(EA), eV:	-9.91(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-hydroxy-2-(hydroxymethyl)oxolan-2-yl]-1,3-diazinane-2,4-dione

Drug info:

PubChemData

Smile

CC(=O)SC1CC(N(C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])CCCNC(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

DOS

IR

Vibrations