Geometry & MOs

Info

ID:	377954
PubChem CID:	134224021
Reduced:	NC18H29 (1)
Stoich.:	AB18C29 (1)
Weight, g/mol:	377.162708
ΔH_f, kcal/mol:	47.68
Dipole, Da:	2.16
IP(EA), eV:	-8.22(1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-(2-cyclopropylethynyl)-10-methoxy-2-oxo-6-propan-2-yl-6,7-dihydrobenzo[a]quinolizine-3-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)C(C/C(=C/C(C)C#CC1CC1)/C)N(C)C=C

DOS

IR

Vibrations