Geometry & MOs

Info

ID:	399735
PubChem CID:	135042115
Reduced:	NOH13C15 (1)
Stoich.:	ABC13D15 (1)
Weight, g/mol:	224.08373
ΔH_f, kcal/mol:	40.38
Dipole, Da:	1.83
IP(EA), eV:	-9.67(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-methoxy-10H-phenanthren-9-one

Drug info:

PubChemData

Smile

C1CC1C(=O)C2=CC=CC=C2C3=CC=CC=N3

DOS

IR

Vibrations