Geometry & MOs

Info

ID:	434370
PubChem CID:	135174803
Reduced:	BrN2O3C20H23 (1)
Stoich.:	AB2C3D20E23 (1)
Weight, g/mol:	207.137162
ΔH_f, kcal/mol:	-56.05
Dipole, Da:	4.61
IP(EA), eV:	-9.02(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-propan-2-ylpyrazin-2-yl)oxycyclobutan-1-amine

Drug info:

PubChemData

Smile

COC(=O)C1=CC(=C(C=C1)COC2=CC=C(C=C2)CNCC3CNC3)Br

DOS

IR

Vibrations