Geometry & MOs

Info

ID:	426375
PubChem CID:	135143667
Reduced:	ON2C12H14 (2)
Stoich.:	AB2C12D14 (2)
Weight, g/mol:	404.221226
ΔH_f, kcal/mol:	-14.93
Dipole, Da:	6.46
IP(EA), eV:	-9.28(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,5S)-5-benzyl-2-tert-butyl-N-(4-cyanophenyl)-N,3-dimethyl-4-oxoimidazolidine-1-carboxamide

Drug info:

PubChemData

Smile

CCCCC1N(C(=O)[C@@H](N1C(=O)N(C)C2=CC=C(C=C2)C#N)CC3=CC=CC=C3)C

DOS

IR

Vibrations