Geometry & MOs

Info

ID:	408274
PubChem CID:	135081038
Reduced:	NS2O3C9H11 (1)
Stoich.:	AB2C3D9E11 (1)
Weight, g/mol:	175.099714
ΔH_f, kcal/mol:	-92.37
Dipole, Da:	2.04
IP(EA), eV:	-9.3(-1.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-bis(ethenyl)-1-prop-2-ynylpyrrolidin-2-one

Drug info:

PubChemData

Smile

CC(C)N1C(=O)/C(=C\C(=O)OC)/SC1=S

DOS

IR

Vibrations