Geometry & MOs

Info

ID:	403429
PubChem CID:	135060221
Reduced:	NO4C9H19 (1)
Stoich.:	AB4C9D19 (1)
Weight, g/mol:	490.113333
ΔH_f, kcal/mol:	-124.03
Dipole, Da:	4.73
IP(EA), eV:	-10.39(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-(dimethylsulfamoyl)-N-methyl-N-phenyl-4-thiophen-3-ylpyrido[3,4-b]indole-3-carboxamide

Drug info:

PubChemData

Smile

CCCC[C@@H](C[N+](=O)[O-])C(OC)OC

DOS

IR

Vibrations