Geometry & MOs

Info

ID:	299411
PubChem CID:	117682853
Reduced:	SN3H15C19 (1)
Stoich.:	AB3C15D19 (1)
Weight, g/mol:	366.060903
ΔH_f, kcal/mol:	102.82
Dipole, Da:	1.93
IP(EA), eV:	-8.43(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[[4-(5-pyridin-2-ylthiophen-2-yl)-1,3-thiazol-2-yl]amino]pyridin-4-yl]methanol

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=CSC(=N2)NC3=CC4=CC=CC=C4C=N3

DOS

IR

Vibrations