Geometry & MOs

Info

ID:	161404
PubChem CID:	57391564
Reduced:	Cl2N5O5C34H37 (1)
Stoich.:	A2B5C5D34E37 (1)
Weight, g/mol:	362.177647
ΔH_f, kcal/mol:	-147.74
Dipole, Da:	5.71
IP(EA), eV:	-8.82(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2,11-dimethyl-1,3,4,4a,5,6,11,11a-octahydropyrido[4,3-b]carbazol-9-yl)amino]methanesulfonamide

Drug info:

PubChemData

Smile

CC(C)OC1=C(C=CC(=C1)OC)C2=N[C@@H]([C@@H](N2C(=O)NCC(=O)N3CCN(CC3)C(=O)C)C4=CC=C(C=C4)Cl)C5=CC=C(C=C5)Cl

DOS

IR

Vibrations