Geometry & MOs

Info

ID:	323097
PubChem CID:	126672398
Reduced:	NC10H21 (2)
Stoich.:	AB10C21 (2)
Weight, g/mol:	197.084064
ΔH_f, kcal/mol:	-70.95
Dipole, Da:	2.49
IP(EA), eV:	-8.47(2.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-methyl-3,4-dihydrocyclopenta[c]isoquinolin-5-one

Drug info:

PubChemData

Smile

CCCCCCCCC(CCCCCCC)N1CCNCC1

DOS

IR

Vibrations