Geometry & MOs

Info

ID:	438948
PubChem CID:	135228709
Reduced:	NC23H35 (1)
Stoich.:	AB23C35 (1)
Weight, g/mol:	532.377727
ΔH_f, kcal/mol:	-10.52
Dipole, Da:	1.09
IP(EA), eV:	-8.98(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 9-[(Z)-1-amino-3-[1-(methylamino)hexan-3-ylimino]prop-1-en-2-yl]-6-tert-butyl-10-ethyl-2-methylidene-6,7-dihydrobenzo[a]quinolizine-3-carboxylate

Drug info:

PubChemData

Smile

CC=N/C=C(\C)/C1=CC=CC(=C1C(C)CC(C)C2CCCCC2)C

DOS

IR

Vibrations