Geometry & MOs

Info

ID:	165054
PubChem CID:	74489692
Reduced:	N4O5C23H36 (1)
Stoich.:	A4B5C23D36 (1)
Weight, g/mol:	446.289306
ΔH_f, kcal/mol:	-218.64
Dipole, Da:	4.11
IP(EA), eV:	-8.63(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-amino-1-butyl-2,4-dioxo-1,3-diazinan-5-yl)-4-(3-methylphenoxy)-N-pentylbutanamide

Drug info:

PubChemData

Smile

CCCCN1C(C(C(=O)NC1=O)N(CCOC)C(=O)COC2=CC(=C(C=C2)C(C)C)C)N

DOS

IR

Vibrations