Geometry & MOs

Info

ID:	273581
PubChem CID:	103771413
Reduced:	NF3O3C14H18 (1)
Stoich.:	AB3C3D14E18 (1)
Weight, g/mol:	283.251129
ΔH_f, kcal/mol:	-294.47
Dipole, Da:	1.24
IP(EA), eV:	-9.93(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-tert-butyl-N-(2-hydroxy-4-methylpentyl)cyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)CC(CNC(=O)C1=CC=C(C=C1)OC(F)(F)F)O

DOS

IR

Vibrations