Geometry & MOs

Info

ID:	40645
PubChem CID:	8144463
Reduced:	Cl2N3O3C15H18 (1)
Stoich.:	A2B3C3D15E18 (1)
Weight, g/mol:	387.125277
ΔH_f, kcal/mol:	-91.87
Dipole, Da:	2.5
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.758387
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-3-[[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]benzenesulfonamide

Drug info:

PubChemData

Smile

C[C@@]1(C(=O)N(C(=O)N1)C[NH+]2CCOCC2)C3=C(C=C(C=C3)Cl)Cl

DOS

IR

Vibrations