Geometry & MOs

Info

ID:	336337
PubChem CID:	127255344
Reduced:	ON4C23H30 (1)
Stoich.:	AB4C23D30 (1)
Weight, g/mol:	385.07897
ΔH_f, kcal/mol:	8.06
Dipole, Da:	7.28
IP(EA), eV:	-8.66(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6-bromo-1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)-4-pyrrol-1-ylbutan-1-one

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2N=C1C3CCCCN3C(=O)CCCCCN4C=CC=C4

DOS

IR

Vibrations