Geometry & MOs

Info

ID:	306134
PubChem CID:	125001711
Reduced:	N2O3C19H24 (1)
Stoich.:	A2B3C19D24 (1)
Weight, g/mol:	350.210661
ΔH_f, kcal/mol:	-99.46
Dipole, Da:	4.55
IP(EA), eV:	-9.03(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,3-dihydro-1H-inden-5-yl)-1-[(2R)-2-[6-(dimethylamino)pyrazin-2-yl]pyrrolidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC1=CC2=C(O1)C=CC(=C2)C(=O)N3CC[C@](C3)(CN4CCCC4)O

DOS

IR

Vibrations