Geometry & MOs

Info

ID:	11919
PubChem CID:	123326
Reduced:	CH (18)
Stoich.:	AB (18)
Weight, g/mol:	234.140851
ΔH_f, kcal/mol:	47.21
Dipole, Da:	0.95
IP(EA), eV:	-8.11(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-tert-butylanthracene

Drug info:

PubChemData

Smile

CC(C)(C)C1=C2C=CC=CC2=CC3=CC=CC=C31

DOS

IR

Vibrations