Geometry & MOs

Info

ID:	270202
PubChem CID:	103633910
Reduced:	ON5C13H17 (1)
Stoich.:	AB5C13D17 (1)
Weight, g/mol:	297.98878
ΔH_f, kcal/mol:	18.59
Dipole, Da:	1.54
IP(EA), eV:	-8.57(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-N-[(4-bromothiophen-2-yl)methyl]-3-N-methylpyrazine-2,3-diamine

Drug info:

PubChemData

Smile

CC(C)OC1=C(C=CC=N1)CNC2=NC=CN=C2N

DOS

IR

Vibrations