Geometry & MOs

Info

ID:	155364
PubChem CID:	56352964
Reduced:	O3N6C20H30 (1)
Stoich.:	A3B6C20D30 (1)
Weight, g/mol:	481.214761
ΔH_f, kcal/mol:	-112.6
Dipole, Da:	6.32
IP(EA), eV:	-9.65(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-tert-butyl-2-methyl-N-[3-[4-(1,2,4-triazol-1-yl)piperidine-1-carbonyl]phenyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC1CC(CC2(C1)C(=O)N(C(=O)N2)CC(=O)N3CCC(CC3)N4C=NC=N4)(C)C

DOS

IR

Vibrations