Geometry & MOs

Info

ID:	5776
PubChem CID:	13767
Reduced:	O2H16C19 (1)
Stoich.:	A2B16C19 (1)
Weight, g/mol:	276.11503
ΔH_f, kcal/mol:	-39.14
Dipole, Da:	2.82
IP(EA), eV:	-8.79(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-methyl-5,6-dihydrobenzo[a]anthracene-5,6-diol

Drug info:

PubChemData

Smile

CC1=C2C(C(C3=CC=CC=C3C2=CC4=CC=CC=C14)O)O

DOS

IR

Vibrations