Geometry & MOs

Info

ID:	377778
PubChem CID:	134223843
Reduced:	NO7C23H27 (1)
Stoich.:	AB7C23D27 (1)
Weight, g/mol:	383.173273
ΔH_f, kcal/mol:	-252.77
Dipole, Da:	14.89
IP(EA), eV:	-9.1(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6S)-10-(2-methoxyethyl)-2-oxo-6-propan-2-yl-6,7,10,11-tetrahydro-[1]benzofuro[5,6-a]quinolizine-3-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)[C@@H]1C(C2=CC(=C(C=C2C3=CC(=O)C(=CN13)C(=O)O)OC)OC4CC(C4)OC)O

DOS

IR

Vibrations