Geometry & MOs

Info

ID:	426393
PubChem CID:	135143800
Reduced:	ON2C9H13 (2)
Stoich.:	AB2C9D13 (2)
Weight, g/mol:	328.189926
ΔH_f, kcal/mol:	-54.48
Dipole, Da:	3.53
IP(EA), eV:	-9.54(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-butyl-N-(4-cyanophenyl)-N,3,5-trimethyl-4-oxoimidazolidine-1-carboxamide

Drug info:

PubChemData

Smile

C[C@H]1C(N([C@H](N1C(=O)N(C)C2=CC=C(C=C2)C#N)C(C)(C)C)C)O

DOS

IR

Vibrations