Geometry & MOs

Info

ID:	404605
PubChem CID:	135067562
Reduced:	ClO2C14H15 (1)
Stoich.:	AB2C14D15 (1)
Weight, g/mol:	503.090243
ΔH_f, kcal/mol:	-65.83
Dipole, Da:	1.93
IP(EA), eV:	-9.24(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (11bS)-3-(3,5-dichloro-2-hydroxybenzoyl)-9,10-dimethoxy-11b-methyl-6,7-dihydrobenzo[a]quinolizine-1-carboxylate

Drug info:

PubChemData

Smile

CC1=C(CO[C@H](C1)C(=O)C2=CC=C(C=C2)Cl)C

DOS

IR

Vibrations