Geometry & MOs

Info

ID:	169169
PubChem CID:	75069905
Reduced:	SN5O6C40H57 (1)
Stoich.:	AB5C6D40E57 (1)
Weight, g/mol:	407.953882
ΔH_f, kcal/mol:	-274.31
Dipole, Da:	5.31
IP(EA), eV:	-9.07(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-(hydroxymethyl)-4-(trichloromethyldisulfanyl)oxolan-2-yl]-5-methyl-1,3-diazinane-2,4-dione

Drug info:

PubChemData

Smile

CC(C)C(C)NC(=O)C1C(SCN1C(=O)C(C(CC2=CC=CC=C2)NC(=O)C(C(C)(C)C)NC(=O)C(C3=CC=CC=C3)NC(=O)CCC=C)O)(C)C

DOS

IR

Vibrations