Geometry & MOs

Info

ID:	146553
PubChem CID:	53704564
Reduced:	NOC20H33 (1)
Stoich.:	ABC20D33 (1)
Weight, g/mol:	274.09938
ΔH_f, kcal/mol:	-95.55
Dipole, Da:	2.91
IP(EA), eV:	-8.59(0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methoxybenzo[a]anthracen-12-ol

Drug info:

PubChemData

Smile

C1CCC(CC1)CN2C3CCCCC3CC4C2CCCC4=O

DOS

IR

Vibrations