Geometry & MOs

Info

ID:	45894
PubChem CID:	10518786
Reduced:	NO3F4C13H13 (1)
Stoich.:	AB3C4D13E13 (1)
Weight, g/mol:	306.09831
ΔH_f, kcal/mol:	-327.42
Dipole, Da:	1.72
IP(EA), eV:	-10.02(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-bromo-1',1'-dimethylspiro[2,3-dihydro-1H-naphthalene-4,4'-cyclohexane]

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations