Geometry & MOs

Info

ID:	217594
PubChem CID:	85088078
Reduced:	O2H24C27 (1)
Stoich.:	A2B24C27 (1)
Weight, g/mol:	380.246378
ΔH_f, kcal/mol:	124.46
Dipole, Da:	3.58
IP(EA), eV:	-8.65(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(7-methyl-4-propan-2-yl-6,6a,8,9-tetrahydroindolo[4,3-fg]quinolin-9-yl)methyl 2-methylbutanoate

Drug info:

PubChemData

Smile

CC(=CC=CC(=O)C=CC1=CC=CC=C(C1)C=CC(=O)C=CC=C(C)C#C)C#C

DOS

IR

Vibrations