Geometry & MOs

Info

ID:	348913
PubChem CID:	127274638
Reduced:	O2S2N3C15H19 (1)
Stoich.:	A2B2C3D15E19 (1)
Weight, g/mol:	273.063506
ΔH_f, kcal/mol:	-37.51
Dipole, Da:	3.19
IP(EA), eV:	-8.34(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopropylsulfonyl-6,8-difluoro-3,4-dihydro-2H-quinoline

Drug info:

PubChemData

Smile

CC1=NC=C(N1)S(=O)(=O)NC2=CC=CC=C2SC3CCCC3

DOS

IR

Vibrations