Geometry & MOs

Info

ID:	169671
PubChem CID:	75135150
Reduced:	N3O5C20H27 (1)
Stoich.:	A3B5C20D27 (1)
Weight, g/mol:	416.151826
ΔH_f, kcal/mol:	-209.41
Dipole, Da:	2.54
IP(EA), eV:	-8.64(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-benzyl-5-(methylamino)-2,6-dioxo-1,3-diazinan-4-yl]-3,4-dimethylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC1C(C(=O)NC(=O)N1)CCC(=O)N2CCCC2C3=C(C=CC(=C3)OC)OC

DOS

IR

Vibrations