Geometry & MOs

Info

ID:	220423
PubChem CID:	85189543
Reduced:	NO4C22H27 (1)
Stoich.:	AB4C22D27 (1)
Weight, g/mol:	369.172879
ΔH_f, kcal/mol:	-155.22
Dipole, Da:	0.96
IP(EA), eV:	-9.4(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-11-carboxylate

Drug info:

PubChemData

Smile

CC(C)C(C1=CC=CC=C1)OC(=O)NC(C)(CC2=CC=CC=C2)C(=O)OC

DOS

IR

Vibrations