Geometry & MOs

Info

ID:	377763
PubChem CID:	134223828
Reduced:	SO2N3C5H9 (1)
Stoich.:	AB2C3D5E9 (1)
Weight, g/mol:	459.181251
ΔH_f, kcal/mol:	-27.4
Dipole, Da:	2.75
IP(EA), eV:	-8.95(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 10-chloro-9-[(3-methoxycyclobutyl)methoxy]-2-oxo-6-propan-2-yl-6,7-dihydrobenzo[a]quinolizine-3-carboxylate

Drug info:

PubChemData

Smile

CC1=NN(N=C1CS(=O)O)C

DOS

IR

Vibrations