Geometry & MOs

Info

ID:	360315
PubChem CID:	127300958
Reduced:	ON2C10H16 (2)
Stoich.:	AB2C10D16 (2)
Weight, g/mol:	394.236876
ΔH_f, kcal/mol:	-103.09
Dipole, Da:	3.01
IP(EA), eV:	-8.76(0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-dimethylphenyl)-4-[2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidine-1-carbonyl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)C2CCCN2C(=O)CC(C)NC(=O)C3CCCC3

DOS

IR

Vibrations