Geometry & MOs

Info

ID:	178564
PubChem CID:	76349404
Reduced:	SN3O5H19C20 (1)
Stoich.:	AB3C5D19E20 (1)
Weight, g/mol:	493.178376
ΔH_f, kcal/mol:	-145.73
Dipole, Da:	7.39
IP(EA), eV:	-9.07(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-(benzylamino)-3-(2-methoxyethyl)-2,6-dioxo-1,3-diazinan-4-yl]-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(=O)OCCCN2C(=O)C3C=CC=CC3=NC2=O)SCC(=O)N

DOS

IR

Vibrations