Geometry & MOs

Info

ID:	416213
PubChem CID:	135089223
Reduced:	OCl2N3C18H23 (1)
Stoich.:	AB2C3D18E23 (1)
Weight, g/mol:	363.125277
ΔH_f, kcal/mol:	11.8
Dipole, Da:	4.21
IP(EA), eV:	-8.81(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]quinoline-6-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1=NOC(=C1)CN2CCN(CC2)CC3=CC(=C(C=C3)Cl)Cl

DOS

IR

Vibrations