Geometry & MOs

Info

ID:	185191
PubChem CID:	77268441
Reduced:	N4O5C24H26 (1)
Stoich.:	A4B5C24D26 (1)
Weight, g/mol:	419.278407
ΔH_f, kcal/mol:	-144.28
Dipole, Da:	6.89
IP(EA), eV:	-8.72(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(1-heptan-4-yl-5-oxo-2-propan-2-ylimidazolidin-4-yl)-1-hydroxy-3-phenylpropan-2-yl]carbamic acid

Drug info:

PubChemData

Smile

C1CCC(C(C1)C(=O)N2CCC3=C(C2)C4=C(N3)C(=CC=C4)O)(C5CC5(C#N)C(=O)N)C(=O)O

DOS

IR

Vibrations