Geometry & MOs

Info

ID:	78446
PubChem CID:	49689731
Reduced:	SO2N4C18H22 (1)
Stoich.:	AB2C4D18E22 (1)
Weight, g/mol:	358.146347
ΔH_f, kcal/mol:	-28.99
Dipole, Da:	7.85
IP(EA), eV:	-9.61(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C(=O)NCC2CCN(CC2)C(=O)C3=C(N=NS3)C

DOS

IR

Vibrations