Geometry & MOs

Info

ID:	188581
PubChem CID:	77738047
Reduced:	N5O5C21H39 (1)
Stoich.:	A5B5C21D39 (1)
Weight, g/mol:	319.189592
ΔH_f, kcal/mol:	-274.1
Dipole, Da:	2.83
IP(EA), eV:	-9.32(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(3-ethyl-4-methylanilino)-3-(3-hydroxybutyl)-1,3-diazinane-2,4-dione

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC(CCCCN=C(N)NC(=O)OC(C)(C)C)C(=O)N1CCCC1

DOS

IR

Vibrations