Geometry & MOs

Info

ID:	154285
PubChem CID:	56313697
Reduced:	BrO2N5H20C21 (1)
Stoich.:	AB2C5D20E21 (1)
Weight, g/mol:	392.122835
ΔH_f, kcal/mol:	20.66
Dipole, Da:	4.84
IP(EA), eV:	-9.01(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,5-dimethylpiperidine-1-carbonyl)-N-(4-methylphenyl)thiophene-3-sulfonamide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)/C=C/C(=O)NC2=CC=CC(=C2)C(=O)NC3=NC=C(C=C3)Br

DOS

IR

Vibrations