Geometry & MOs

Info

ID:	366287
PubChem CID:	127319744
Reduced:	O3N4C16H20 (1)
Stoich.:	A3B4C16D20 (1)
Weight, g/mol:	306.115047
ΔH_f, kcal/mol:	-97.33
Dipole, Da:	7.37
IP(EA), eV:	-9.11(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonyl)-7a-methyl-2,3,6,7-tetrahydropyrrolo[2,1-b][1,3]thiazol-5-one

Drug info:

PubChemData

Smile

C1CCC2C(C1)C(=O)N(C2=O)CC(=O)N3CCN4C=CN=C4C3

DOS

IR

Vibrations