Geometry & MOs

Info

ID:	439053
PubChem CID:	135228816
Reduced:	N3O4C26H29 (1)
Stoich.:	A3B4C26D29 (1)
Weight, g/mol:	362.235814
ΔH_f, kcal/mol:	-116.83
Dipole, Da:	6.74
IP(EA), eV:	-9.16(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-tert-butyl-10-ethyl-2-methylidene-3-prop-1-en-2-yl-6,7-dihydrobenzo[a]quinolizine-9-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=C(CC(N3C2=CC(=O)C(=C3)C(=O)C)C(C)(C)C)C=C1C4=CN(N=C4)CCC(=O)O

DOS

IR

Vibrations