Geometry & MOs

Info

ID:	393169
PubChem CID:	135019617
Reduced:	NC15H21 (1)
Stoich.:	AB15C21 (1)
Weight, g/mol:	306.125594
ΔH_f, kcal/mol:	33.43
Dipole, Da:	1.77
IP(EA), eV:	-8.38(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7,12-dimethoxy-5,6-dihydrobenzo[a]anthracen-6-ol

Drug info:

PubChemData

Smile

CC(C)[C@@H]1C[C@H]2C[C@H]2N1CC3=CC=CC=C3

DOS

IR

Vibrations