Geometry & MOs

Info

ID:	254812
PubChem CID:	103127885
Reduced:	SN4H12C15 (1)
Stoich.:	AB4C12D15 (1)
Weight, g/mol:	291.059696
ΔH_f, kcal/mol:	123.64
Dipole, Da:	1.61
IP(EA), eV:	-8.7(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-chlorothiophen-2-yl)-pyrazolo[1,5-a]pyridin-3-ylmethyl]ethanamine

Drug info:

PubChemData

Smile

C1=CC2=C(C(=C1)C(C3=C4C=NC=CN4N=C3)N)SC=C2

DOS

IR

Vibrations