Geometry & MOs

Info

ID:	360305
PubChem CID:	127300948
Reduced:	SO2N4C20H26 (1)
Stoich.:	AB2C4D20E26 (1)
Weight, g/mol:	382.236876
ΔH_f, kcal/mol:	-36.71
Dipole, Da:	5.34
IP(EA), eV:	-9.02(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,6,6-trimethyl-2-[2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidine-1-carbonyl]-5,7-dihydro-1H-indol-4-one

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)C2CCCN2C(=O)[C@@H]3CCCN3C(=O)C4=CC=CS4

DOS

IR

Vibrations