Geometry & MOs

Info

ID:	438909
PubChem CID:	135228670
Reduced:	NO6C20H23 (1)
Stoich.:	AB6C20D23 (1)
Weight, g/mol:	402.267114
ΔH_f, kcal/mol:	-158.58
Dipole, Da:	8.0
IP(EA), eV:	-8.56(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-2-(10-methoxy-2-methylidene-3-pent-1-en-2-yl-6-propan-2-yl-6,7-dihydrobenzo[a]quinolizin-9-yl)but-2-en-1-imine

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)CC[C@@H](CC2=CC(=C(C=C2)O)OC)C(=O)OC)N=O

DOS

IR

Vibrations