Geometry & MOs

Info

ID:	445922
PubChem CID:	135269939
Reduced:	O2N6C23H26 (1)
Stoich.:	A2B6C23D26 (1)
Weight, g/mol:	232.10342
ΔH_f, kcal/mol:	52.13
Dipole, Da:	3.6
IP(EA), eV:	-8.92(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-propan-2-ylsulfanylphenyl)-2,3-dihydropyrazine

Drug info:

PubChemData

Smile

CC1=NC=C(N=C1C(=N)OC(=N)C2=CC=CC=C2)C3=CN=C(C=C3)OCCCN(C)C

DOS

IR

Vibrations