Geometry & MOs

Info

ID:	291715
PubChem CID:	113460454
Reduced:	N3O3C12H17 (1)
Stoich.:	A3B3C12D17 (1)
Weight, g/mol:	357.114713
ΔH_f, kcal/mol:	-101.88
Dipole, Da:	5.31
IP(EA), eV:	-8.77(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-N-benzyl-N-(2-hydroxyethyl)quinoline-8-sulfonamide

Drug info:

PubChemData

Smile

CC(C)OC(=O)NC1=C(C=C(C=C1)C(=N)N)OC

DOS

IR

Vibrations