Geometry & MOs

Info

ID:	1185
PubChem CID:	3938
Reduced:	ON4C20H26 (1)
Stoich.:	AB4C20D26 (1)
Weight, g/mol:	338.210661
ΔH_f, kcal/mol:	-4.67
Dipole, Da:	3.73
IP(EA), eV:	-8.3(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1-diethyl-3-(7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinolin-9-yl)urea

Drug info:

PubChemData

Smile

CCN(CC)C(=O)NC1CN(C2CC3=CNC4=CC=CC(=C34)C2=C1)C

DOS

IR

Vibrations