Geometry & MOs

Info

ID:	257361
PubChem CID:	103145495
Reduced:	SN2O3C12H16 (1)
Stoich.:	AB2C3D12E16 (1)
Weight, g/mol:	204.126263
ΔH_f, kcal/mol:	-108.84
Dipole, Da:	0.49
IP(EA), eV:	-8.3(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-amino-2,5-dimethylphenyl)pyrrolidin-2-one

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1N2C(=O)C(S2(=O)=O)(C)C)C)N

DOS

IR

Vibrations