Geometry & MOs

Info

ID:	329928
PubChem CID:	127246795
Reduced:	O2N4C17H22 (1)
Stoich.:	A2B4C17D22 (1)
Weight, g/mol:	302.120132
ΔH_f, kcal/mol:	-9.43
Dipole, Da:	6.05
IP(EA), eV:	-8.45(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[2-(dimethylamino)pyridin-4-yl]pyrrolidin-1-yl]-(1,3-thiazol-4-yl)methanone

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)C(=O)N2CCCC2C3=CC(=NC=C3)N(C)C

DOS

IR

Vibrations