Geometry & MOs

Info

ID:	349915
PubChem CID:	127276720
Reduced:	NOC5H8 (4)
Stoich.:	ABC5D8 (4)
Weight, g/mol:	392.16306
ΔH_f, kcal/mol:	-220.73
Dipole, Da:	7.23
IP(EA), eV:	-9.44(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-(4-ethyl-1,2,4-triazol-3-yl)piperidin-1-yl]-2-oxoethyl]-N-methylpyridine-3-sulfonamide

Drug info:

PubChemData

Smile

CC1CC(CC2(C1)C(=O)N(C(=O)N2)CC(=O)NC3CC(=O)N(C3)C(C)C)(C)C

DOS

IR

Vibrations