Geometry & MOs

Info

ID:	258939
PubChem CID:	103157481
Reduced:	NOSC15H25 (1)
Stoich.:	ABCD15E25 (1)
Weight, g/mol:	207.11201
ΔH_f, kcal/mol:	-54.46
Dipole, Da:	1.34
IP(EA), eV:	-8.85(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-3-([1,2,4]triazolo[4,3-a]pyrazin-3-yl)propan-1-amine

Drug info:

PubChemData

Smile

CC(CC1=CSC=C1)NCC(CC2CCCC2)O

DOS

IR

Vibrations