Geometry & MOs

Info

ID:	372262
PubChem CID:	131294826
Reduced:	NO2F3H6C10 (1)
Stoich.:	AB2C3D6E10 (1)
Weight, g/mol:	270.01162
ΔH_f, kcal/mol:	-167.21
Dipole, Da:	7.11
IP(EA), eV:	-10.04(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-1-(2-bromoimidazo[1,2-a]pyrimidin-3-yl)propan-1-ol

Drug info:

PubChemData

Smile

COC1=C(C(=C(C=C1)C#N)C=O)C(F)(F)F

DOS

IR

Vibrations