Geometry & MOs

Info

ID:	192599
PubChem CID:	78290610
Reduced:	SCl2N2O3C22H24 (1)
Stoich.:	AB2C2D3E22F24 (1)
Weight, g/mol:	424.211055
ΔH_f, kcal/mol:	-107.65
Dipole, Da:	5.75
IP(EA), eV:	-9.34(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-amino-1-benzyl-2,4-dioxo-1,3-diazinan-5-yl)-N-butyl-2-phenoxyacetamide

Drug info:

PubChemData

Smile

C1CC(C2=CC=CC=C2C1)NC(=O)C3CCN(CC3)S(=O)(=O)C4=C(C(=CC=C4)Cl)Cl

DOS

IR

Vibrations