Geometry & MOs

Info

ID:	42969
PubChem CID:	10317459
Reduced:	NO5C21H31 (1)
Stoich.:	AB5C21D31 (1)
Weight, g/mol:	377.199094
ΔH_f, kcal/mol:	-230.54
Dipole, Da:	3.05
IP(EA), eV:	-8.7(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,9-dimethoxy-6-pentyl-5,6-dihydroindolo[2,1-a]isoquinoline-12-carbaldehyde

Drug info:

PubChemData

Smile

CCCOC(=O)NCCOC1=CC=C(C=C1)CC2CCCCC23OCCO3

DOS

IR

Vibrations