Geometry & MOs

Info

ID:	246362
PubChem CID:	103059377
Reduced:	OSN2C17H28 (1)
Stoich.:	ABC2D17E28 (1)
Weight, g/mol:	335.06332
ΔH_f, kcal/mol:	-13.56
Dipole, Da:	2.63
IP(EA), eV:	-8.78(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2-bromophenyl)methoxymethyl]-N-propylpyrazin-2-amine

Drug info:

PubChemData

Smile

CCCNC1CCOCC1CN(CC2=CSC=C2)C3CC3

DOS

IR

Vibrations