Geometry & MOs

Info

ID:	441123
PubChem CID:	135233225
Reduced:	NPC19H30 (1)
Stoich.:	ABC19D30 (1)
Weight, g/mol:	393.324294
ΔH_f, kcal/mol:	23.12
Dipole, Da:	3.94
IP(EA), eV:	-8.28(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hexyl-1-(6-oxotetradecyl)pyrrolidine-2,5-dione

Drug info:

PubChemData

Smile

CC(C)C(=C)C1=C(C=C(CC1=C)C(C)CC/C=C/NC)P

DOS

IR

Vibrations