Geometry & MOs

Info

ID:	176936
PubChem CID:	76114758
Reduced:	OC21H28 (1)
Stoich.:	AB21C28 (1)
Weight, g/mol:	181.146664
ΔH_f, kcal/mol:	-43.25
Dipole, Da:	6.28
IP(EA), eV:	-9.34(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-3-(3-methylbut-3-enyl)pyrrolidin-2-one

Drug info:

PubChemData

Smile

CC=C1CCC2C1(CCC3C2CCC4=CC(=O)C=CC34C)C

DOS

IR

Vibrations