Geometry & MOs

Info

ID:	438734
PubChem CID:	135228487
Reduced:	N3O4C28H35 (1)
Stoich.:	A3B4C28D35 (1)
Weight, g/mol:	439.298748
ΔH_f, kcal/mol:	-128.53
Dipole, Da:	7.82
IP(EA), eV:	-8.34(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(6-tert-butyl-10-ethyl-2-methylidene-3-prop-1-en-2-yl-6,7-dihydrobenzo[a]quinolizin-9-yl)-N,N-dimethylpyridin-2-amine

Drug info:

PubChemData

Smile

CC(C(C1=CN2C(CC3=CC(=C(C=C3C2=CC1=O)OC)C4=CN=C(C=C4)N(C)C)C(C)(C)C)O)O

DOS

IR

Vibrations