Geometry & MOs

Info

ID:	26634
PubChem CID:	794383
Reduced:	SN2O3C16H16 (1)
Stoich.:	AB2C3D16E16 (1)
Weight, g/mol:	265.146664
ΔH_f, kcal/mol:	-58.06
Dipole, Da:	9.15
IP(EA), eV:	-9.12(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,5-dimethyl-3-(naphthalen-1-ylamino)cyclohex-2-en-1-one

Drug info:

PubChemData

Smile

CCOC1=CC=C(C2=CC=CC=C21)S(=O)(=O)N3C=CN=C3C

DOS

IR

Vibrations