Geometry & MOs

Info

ID:	418238
PubChem CID:	135103928
Reduced:	O2N4C19H24 (1)
Stoich.:	A2B4C19D24 (1)
Weight, g/mol:	348.150764
ΔH_f, kcal/mol:	-25.84
Dipole, Da:	3.78
IP(EA), eV:	-9.01(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-[(3R,4S)-4-(quinolin-4-ylmethyl)oxolan-3-yl]propane-1-sulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=NN1C2=CC=CC(=C2)CN3C[C@@H]4COC[C@H](C3)NC4=O)C

DOS

IR

Vibrations