Geometry & MOs

Info

ID:	371223
PubChem CID:	127344389
Reduced:	OSN5C15H21 (1)
Stoich.:	ABC5D15E21 (1)
Weight, g/mol:	397.13726
ΔH_f, kcal/mol:	12.6
Dipole, Da:	3.74
IP(EA), eV:	-9.35(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-fluorophenyl)-4,5,6,7-tetrahydro-1,3-benzothiazol-7-yl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC=N1)CNC(=O)N2CCC(CC2)C3=CC=NN3C

DOS

IR

Vibrations