Geometry & MOs

Info

ID:	306240
PubChem CID:	125003181
Reduced:	N3C8H12 (2)
Stoich.:	A3B8C12 (2)
Weight, g/mol:	382.193966
ΔH_f, kcal/mol:	68.28
Dipole, Da:	4.96
IP(EA), eV:	-8.85(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(3S)-1-(1H-imidazol-2-ylmethyl)piperidin-3-yl]-6-methylpyridin-4-yl]-4,5-dimethyl-1,3-thiazol-2-amine

Drug info:

PubChemData

Smile

CN1C=CN=C1CN2CCC[C@H]2C3=NC=CC(=N3)CN(C)C

DOS

IR

Vibrations