Geometry & MOs

Info

ID:	330004
PubChem CID:	127246991
Reduced:	ON5C18H29 (1)
Stoich.:	AB5C18D29 (1)
Weight, g/mol:	352.201159
ΔH_f, kcal/mol:	-24.01
Dipole, Da:	4.89
IP(EA), eV:	-8.34(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[6-(methylamino)pyrazin-2-yl]pyrrolidin-1-yl]-(2-pyrrolidin-1-ylpyridin-4-yl)methanone

Drug info:

PubChemData

Smile

CC(C)N1CCC(CC1)C(=O)N2CCCC2C3=CN=CC(=N3)NC

DOS

IR

Vibrations