Geometry & MOs

Info

ID:	78462
PubChem CID:	49689820
Reduced:	SO4N5C18H21 (1)
Stoich.:	AB4C5D18E21 (1)
Weight, g/mol:	404.151826
ΔH_f, kcal/mol:	-31.19
Dipole, Da:	7.23
IP(EA), eV:	-9.78(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dimethoxy-N-[[1-(4-methylthiadiazole-5-carbonyl)piperidin-4-yl]methyl]benzamide

Drug info:

PubChemData

Smile

CC1=C(SN=N1)C(=O)N2CCC(CC2)CNC(=O)CC3=CC=C(C=C3)[N+](=O)[O-]

DOS

IR

Vibrations