Geometry & MOs

Info

ID:	204304
PubChem CID:	79944401
Reduced:	O2N3C14H17 (1)
Stoich.:	A2B3C14D17 (1)
Weight, g/mol:	192.089878
ΔH_f, kcal/mol:	-56.58
Dipole, Da:	1.35
IP(EA), eV:	-9.7(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-prop-2-ynyl-6,7,8,8a-tetrahydro-3H-pyrrolo[1,2-a]pyrazine-1,4-dione

Drug info:

PubChemData

Smile

CC(C1=CN=CC=C1)N2CC(=O)N3CCCC3C2=O

DOS

IR

Vibrations