Geometry & MOs

Info

ID:	419148
PubChem CID:	135107604
Reduced:	O3N4C19H22 (1)
Stoich.:	A3B4C19D22 (1)
Weight, g/mol:	351.125277
ΔH_f, kcal/mol:	-70.49
Dipole, Da:	4.73
IP(EA), eV:	-9.57(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-1H-indole-5-carboxamide

Drug info:

PubChemData

Smile

CN1CCC[C@]2([C@H]1CN(CC2)C(=O)C3=C4C(=CC=C3)N=CC=N4)C(=O)O

DOS

IR

Vibrations