Geometry & MOs

Info

ID:	30652
PubChem CID:	841623
Reduced:	SN3O3H11C12 (1)
Stoich.:	AB3C3D11E12 (1)
Weight, g/mol:	277.052112
ΔH_f, kcal/mol:	-78.23
Dipole, Da:	4.11
IP(EA), eV:	-9.14(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5R)-4,6-dioxo-1-phenyl-2-sulfanylidene-1,3-diazinan-5-yl]acetamide

Drug info:

PubChemData

Smile

CC(=O)N[C@H]1C(=O)NC(=S)N(C1=O)C2=CC=CC=C2

DOS

IR

Vibrations