Geometry & MOs

Info

ID:	438883
PubChem CID:	135228643
Reduced:	N3O3C24H29 (1)
Stoich.:	A3B3C24D29 (1)
Weight, g/mol:	375.231063
ΔH_f, kcal/mol:	-79.25
Dipole, Da:	8.75
IP(EA), eV:	-9.07(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-[(Z)-1-amino-3-iminoprop-1-en-2-yl]-10-ethyl-6-propan-2-yl-3-prop-1-en-2-yl-6,7-dihydrobenzo[a]quinolizin-2-one

Drug info:

PubChemData

Smile

CCC1=C(C=C2CC(N3C=C(C(=O)C=C3C2=C1)C(=O)OCC)C(C)C)/C(=C/N)/C=N

DOS

IR

Vibrations