Geometry & MOs

Info

ID:	310550
PubChem CID:	126581999
Reduced:	N2O2C11H14 (1)
Stoich.:	A2B2C11D14 (1)
Weight, g/mol:	219.162314
ΔH_f, kcal/mol:	-65.73
Dipole, Da:	6.08
IP(EA), eV:	-8.87(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-ethylcyclohexyl)methyl]-5-methylidenepyrrol-2-one

Drug info:

PubChemData

Smile

CC(C(=O)O)N1CCCC2=C1N=CC=C2

DOS

IR

Vibrations