Geometry & MOs

Info

ID:	390737
PubChem CID:	135000639
Reduced:	N2O2C21H32 (1)
Stoich.:	A2B2C21D32 (1)
Weight, g/mol:	378.230728
ΔH_f, kcal/mol:	-94.18
Dipole, Da:	3.7
IP(EA), eV:	-8.84(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-5,5-dimethyl-2-(4-methyl-3-phenylpentanoyl)pyrazolidin-3-one

Drug info:

PubChemData

Smile

CCCCN1C(CC(=O)N1C(=O)CC(C2=CC=CC=C2)C(C)C)(C)C

DOS

IR

Vibrations