Geometry & MOs

Info

ID:	121531
PubChem CID:	50772170
Reduced:	SO2N6C24H30 (1)
Stoich.:	AB2C6D24E30 (1)
Weight, g/mol:	468.267131
ΔH_f, kcal/mol:	27.59
Dipole, Da:	6.04
IP(EA), eV:	-8.35(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[5-(tert-butylamino)-6-(3-methylphenyl)imidazo[2,1-b][1,3,4]thiadiazol-2-yl]-methylamino]-N-cycloheptylacetamide

Drug info:

PubChemData

Smile

CC(CC1=CC=CO1)NC(=O)CN(C)C2=NN3C(=C(N=C3S2)C4=CC=CC=C4)NC(C)(C)C

DOS

IR

Vibrations