Geometry & MOs

Info

ID:	156567
PubChem CID:	56371184
Reduced:	ClO2N4C18H21 (1)
Stoich.:	AB2C4D18E21 (1)
Weight, g/mol:	432.01433
ΔH_f, kcal/mol:	-53.83
Dipole, Da:	11.65
IP(EA), eV:	-8.89(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromophenyl)sulfonyl-2-methyl-N-quinolin-6-ylpropanamide

Drug info:

PubChemData

Smile

CC(C)C(=O)N1CCCC1C(=O)NC2=CC(=C(C=C2)N3C=CN=C3)Cl

DOS

IR

Vibrations