Geometry & MOs

Info

ID:	299053
PubChem CID:	117670392
Reduced:	NH15C20 (1)
Stoich.:	AB15C20 (1)
Weight, g/mol:	112.068828
ΔH_f, kcal/mol:	94.53
Dipole, Da:	0.88
IP(EA), eV:	-8.06(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6R)-2-fluoro-6-methylcyclohexa-1,3-diene

Drug info:

PubChemData

Smile

C=C1C2=CC=CC=C2C3=C1C=C(C=C3)NC4=CC=CC=C4

DOS

IR

Vibrations