Geometry & MOs

Info

ID:	436763
PubChem CID:	135211250
Reduced:	N4C27H34 (1)
Stoich.:	A4B27C34 (1)
Weight, g/mol:	383.08848
ΔH_f, kcal/mol:	56.4
Dipole, Da:	1.77
IP(EA), eV:	-8.06(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-8-methoxyspiro[4a,5,11,11b-tetrahydrobenzo[b]carbazole-6,1'-cyclopentane]

Drug info:

PubChemData

Smile

CC(C)N1CCN(CC1)C2=CC3=C(C=C2)C(C4=C(C3)C5=C(N4)C=C(C=C5)C=NC)(C)C

DOS

IR

Vibrations