Geometry & MOs

Info

ID:	350552
PubChem CID:	127278520
Reduced:	SO3N4C15H24 (1)
Stoich.:	AB3C4D15E24 (1)
Weight, g/mol:	352.226312
ΔH_f, kcal/mol:	-101.96
Dipole, Da:	10.54
IP(EA), eV:	-9.3(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-cyclobutylpyrrolidin-1-yl)-[5-methyl-1-(2-propan-2-ylphenyl)-1,2,4-triazol-3-yl]methanone

Drug info:

PubChemData

Smile

CC1=NC(=CN1C)S(=O)(=O)NCC(=O)N2CCCC2C3CCC3

DOS

IR

Vibrations