Geometry & MOs

Info

ID:	1196
PubChem CID:	3972
Reduced:	N2O3C23H32 (1)
Stoich.:	A2B3C23D32 (1)
Weight, g/mol:	384.241293
ΔH_f, kcal/mol:	-130.03
Dipole, Da:	3.92
IP(EA), eV:	-8.11(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hydroxybutan-2-yl 7-methyl-4-propan-2-yl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxylate

Drug info:

PubChemData

Smile

CC(C)N1C=C2CC3C(CC(CN3C)C(=O)OC(C)C(C)O)C4=C2C1=CC=C4

DOS

IR

Vibrations