Geometry & MOs

Info

ID:	198365
PubChem CID:	79091968
Reduced:	O2N3C14H17 (1)
Stoich.:	A2B3C14D17 (1)
Weight, g/mol:	284.167083
ΔH_f, kcal/mol:	-44.62
Dipole, Da:	6.42
IP(EA), eV:	-9.12(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethyl-5-(3-oxo-1,2,5,6,8,8a-hexahydroimidazo[1,5-a]pyrazin-7-yl)pentanethioamide

Drug info:

PubChemData

Smile

C1CN2C(CNC2=O)CN1CC(=O)C3=CC=CC=C3

DOS

IR

Vibrations