Geometry & MOs

Info

ID:	362633
PubChem CID:	127308901
Reduced:	OS2N4C18H30 (1)
Stoich.:	AB2C4D18E30 (1)
Weight, g/mol:	346.157581
ΔH_f, kcal/mol:	-44.56
Dipole, Da:	2.79
IP(EA), eV:	-8.51(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propyl]-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-7-carboxamide

Drug info:

PubChemData

Smile

CCC1=NC(=CS1)C(C)NC(=O)NCC2(CCCC2)N3CCSCC3

DOS

IR

Vibrations