Geometry & MOs

Info

ID:	441219
PubChem CID:	135233703
Reduced:	O3C14H16 (1)
Stoich.:	A3B14C16 (1)
Weight, g/mol:	486.302848
ΔH_f, kcal/mol:	-110.55
Dipole, Da:	1.36
IP(EA), eV:	-9.74(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-[5-(2,2-dimethylpropylamino)-6-(methylamino)pyridin-2-yl]-2,2-dimethylcyclohexyl]-4-ethylbenzenesulfonamide

Drug info:

PubChemData

Smile

COC(=O)C1=CC=C(C=C1)C2=CC(CCC2)O

DOS

IR

Vibrations