Geometry & MOs

Info

ID:	240928
PubChem CID:	93618233
Reduced:	SO2N4C15H24 (1)
Stoich.:	AB2C4D15E24 (1)
Weight, g/mol:	303.169525
ΔH_f, kcal/mol:	-70.53
Dipole, Da:	6.21
IP(EA), eV:	-8.51(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-(2-methylpropoxy)-N-[[6-(1,2,4-triazol-1-yl)pyridin-3-yl]methyl]propanamide

Drug info:

PubChemData

Smile

C[C@@H]1CCCN(C1)CCCNC(=O)C2=CSC(=N2)NC(=O)C

DOS

IR

Vibrations