Geometry & MOs

Info

ID:	49519
PubChem CID:	11533163
Reduced:	SF2O2N4C25H26 (1)
Stoich.:	AB2C2D4E25F26 (1)
Weight, g/mol:	484.283826
ΔH_f, kcal/mol:	-65.24
Dipole, Da:	5.51
IP(EA), eV:	-8.65(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[7-(adamantane-1-carbonylamino)-1,8-naphthyridin-2-yl]adamantane-1-carboxamide

Drug info:

PubChemData

Smile

CN(C)C[C@]12CC3=C(C=C1CCN(C2)S(=O)(=O)C4=CC=C(C=C4)F)N(N=C3)C5=CC=C(C=C5)F

DOS

IR

Vibrations