Geometry & MOs

Info

ID:	444198
PubChem CID:	135261678
Reduced:	N4O5C23H28 (1)
Stoich.:	A4B5C23D28 (1)
Weight, g/mol:	453.181919
ΔH_f, kcal/mol:	-209.91
Dipole, Da:	6.2
IP(EA), eV:	-8.77(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(3-chloro-4-cyanophenoxy)-2,2,4,4-tetramethylcyclobutyl]-6-(4-oxobutyl)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC3=C(C=C2)C(=O)N(C=C3)C4CCC(=O)NC4=O

DOS

IR

Vibrations