Geometry & MOs

Info

ID:	155893
PubChem CID:	56368171
Reduced:	S2N3O3C19H27 (1)
Stoich.:	A2B3C3D19E27 (1)
Weight, g/mol:	436.247441
ΔH_f, kcal/mol:	-100.24
Dipole, Da:	5.01
IP(EA), eV:	-9.46(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[ethyl(propan-2-yl)amino]methyl]-N-[4-methyl-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]benzamide

Drug info:

PubChemData

Smile

CC(C1=CC=C(C=C1)S(=O)(=O)C)N(C)C(=O)NCC2=CSC(=N2)C(C)(C)C

DOS

IR

Vibrations