Geometry & MOs

Info

ID:	330064
PubChem CID:	127247051
Reduced:	O2N6C17H22 (1)
Stoich.:	A2B6C17D22 (1)
Weight, g/mol:	336.195011
ΔH_f, kcal/mol:	-0.88
Dipole, Da:	7.5
IP(EA), eV:	-8.69(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NN(C(=O)C=C1)CC(=O)N2CCCC2C3=CN=CC(=N3)N(C)C

DOS

IR

Vibrations