Geometry & MOs

Info

ID:	350804
PubChem CID:	127279092
Reduced:	ON5C22H31 (1)
Stoich.:	AB5C22D31 (1)
Weight, g/mol:	376.204531
ΔH_f, kcal/mol:	-13.87
Dipole, Da:	2.38
IP(EA), eV:	-8.82(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methylcyclohexyl)-2-[4-(6-methylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1CCC(CC1)NC(=O)CN2CCN(CC2)C3=C(C=C4CCCC4=N3)C#N

DOS

IR

Vibrations