Geometry & MOs

Info

ID:	305513
PubChem CID:	124958145
Reduced:	O2N4C23H26 (1)
Stoich.:	A2B4C23D26 (1)
Weight, g/mol:	352.147016
ΔH_f, kcal/mol:	-14.9
Dipole, Da:	3.09
IP(EA), eV:	-8.69(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[(3S)-1-(1,3-thiazol-4-ylmethyl)piperidin-3-yl]pyridin-2-yl]pyrazin-2-amine

Drug info:

PubChemData

Smile

CC1=CC(=CC(=N1)[C@H]2CCCN(C2)C(=O)C3=C(NN=C3)C)C4=CC=C(C=C4)OC

DOS

IR

Vibrations