Geometry & MOs

Info

ID:	161702
PubChem CID:	57392375
Reduced:	NOC13H17 (2)
Stoich.:	ABC13D17 (2)
Weight, g/mol:	448.215078
ΔH_f, kcal/mol:	-63.23
Dipole, Da:	6.62
IP(EA), eV:	-8.25(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6R,12bS)-12-benzyl-6-(phenylmethoxymethyl)-1,6,7,12b-tetrahydroindolo[2,3-a]quinolizin-4-one

Drug info:

PubChemData

Smile

C=CCOC[C@H]1CC2=C([C@H]3N1C(=O)CCC3)N(C4=CC=CC=C24)CC5CCCCC5

DOS

IR

Vibrations