Geometry & MOs

Info

ID:	64798
PubChem CID:	29204011
Reduced:	ClSN2O4C21H25 (1)
Stoich.:	ABC2D4E21F25 (1)
Weight, g/mol:	480.07184
ΔH_f, kcal/mol:	-101.2
Dipole, Da:	2.06
IP(EA), eV:	-9.45(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-benzylpiperidine-1-carbonyl)-4-bromo-N-methoxy-N-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CN(OC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CCC(CC2)CC3=CC=CC=C3)Cl

DOS

IR

Vibrations