Geometry & MOs

Info

ID:	416689
PubChem CID:	135090118
Reduced:	SN4O4C12H20 (1)
Stoich.:	AB4C4D12E20 (1)
Weight, g/mol:	391.156577
ΔH_f, kcal/mol:	-148.7
Dipole, Da:	6.89
IP(EA), eV:	-9.57(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-2,4-dimethylquinoline-7-carboxamide

Drug info:

PubChemData

Smile

CC1=C(N=CN1)C(=O)N[C@@H]2COC[C@H]2CS(=O)(=O)N(C)C

DOS

IR

Vibrations