Geometry & MOs

Info

ID:	435857
PubChem CID:	135192579
Reduced:	FN2O4C26H27 (1)
Stoich.:	AB2C4D26E27 (1)
Weight, g/mol:	313.204179
ΔH_f, kcal/mol:	-163.44
Dipole, Da:	9.02
IP(EA), eV:	-9.05(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-hydroxynaphthalen-1-yl)-4,4-dimethyl-2-propan-2-ylpentanamide

Drug info:

PubChemData

Smile

CC/C(=C\1/CCCC2=C3CN4C(=CC5=C(C4=O)COC(=O)[C@@]5(CC)O)C3=NC(=C21)/C=C/F)/C

DOS

IR

Vibrations