Geometry & MOs

Info

ID:	177068
PubChem CID:	76132273
Reduced:	N2O2S2C17H20 (1)
Stoich.:	A2B2C2D17E20 (1)
Weight, g/mol:	669.241033
ΔH_f, kcal/mol:	-47.86
Dipole, Da:	2.76
IP(EA), eV:	-9.09(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-hydroxy-5-[1-hydroxy-2,2-bis(4-methoxyphenyl)-2-phenylethyl]oxolan-2-yl]-3-[3,3,3-tris(fluoroamino)prop-1-ynyl]-1,3-diazinane-2,4-dione

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC(CS)C(=O)NC(CC2=CC=CS2)C(=O)N

DOS

IR

Vibrations