Geometry & MOs

Info

ID:	192984
PubChem CID:	78332062
Reduced:	O2S2N5C22H23 (1)
Stoich.:	A2B2C5D22E23 (1)
Weight, g/mol:	410.25292
ΔH_f, kcal/mol:	46.66
Dipole, Da:	5.38
IP(EA), eV:	-8.62(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(cyclododecylamino)-3-hydroxy-1-oxopropan-2-yl]-2,4-dioxo-1,3-diazinane-5-carboxamide

Drug info:

PubChemData

Smile

CC(C)N1C(=NN=C1SCC2=NC(=O)C3C4=C(CCC4)SC3=N2)C5=CC=C(C=C5)OC

DOS

IR

Vibrations