Geometry & MOs

Info

ID:	135497
PubChem CID:	51881394
Reduced:	O3N4C27H34 (1)
Stoich.:	A3B4C27D34 (1)
Weight, g/mol:	386.143092
ΔH_f, kcal/mol:	-99.55
Dipole, Da:	6.49
IP(EA), eV:	-8.47(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[(2S)-3-methylbutan-2-yl]-3-[(3R)-3-methylpiperidin-1-yl]sulfonylbenzamide

Drug info:

PubChemData

Smile

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)[C@H]3CCCN3C(=O)C45CC6CC(C4)CC(C6)C5

DOS

IR

Vibrations