Geometry & MOs

Info

ID:	306049
PubChem CID:	125000934
Reduced:	O3N4C14H24 (1)
Stoich.:	A3B4C14D24 (1)
Weight, g/mol:	355.157915
ΔH_f, kcal/mol:	-89.86
Dipole, Da:	5.07
IP(EA), eV:	-9.02(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(3S)-1-(1H-imidazol-5-ylmethyl)piperidin-3-yl]pyrazin-2-yl]-4-methyl-1,3-thiazol-2-amine

Drug info:

PubChemData

Smile

CCC1=NOC(=N1)CCC(=O)N2CC[C@@](C2)(CN(C)C)O

DOS

IR

Vibrations