Geometry & MOs

Info

ID:	361831
PubChem CID:	127304802
Reduced:	OS2N6C16H24 (1)
Stoich.:	AB2C6D16E24 (1)
Weight, g/mol:	385.157246
ΔH_f, kcal/mol:	23.37
Dipole, Da:	4.49
IP(EA), eV:	-8.78(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(2-methyl-1,3-thiazol-5-yl)methyl]piperazin-1-yl]-(3-propan-2-yl-[1,2]oxazolo[5,4-b]pyridin-5-yl)methanone

Drug info:

PubChemData

Smile

CC1=NC=C(S1)CN2CCN(CC2)C(=O)CSC3=NN=CN3C(C)C

DOS

IR

Vibrations