Geometry & MOs

Info

ID:	8501
PubChem CID:	78555
Reduced:	NOC10H19 (1)
Stoich.:	ABC10D19 (1)
Weight, g/mol:	169.146664
ΔH_f, kcal/mol:	-78.27
Dipole, Da:	4.24
IP(EA), eV:	-9.28(1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-hexylpyrrolidin-2-one

Drug info:

PubChemData

Smile

CCCCCCN1CCCC1=O

DOS

IR

Vibrations