Geometry & MOs

Info

ID:	57035
PubChem CID:	22395248
Reduced:	BrC3N3H6 (1)
Stoich.:	AB3C3D6 (1)
Weight, g/mol:	165.090212
ΔH_f, kcal/mol:	63.14
Dipole, Da:	2.85
IP(EA), eV:	-10.14(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-pyrrolidin-1-yl-1H-pyrimidin-2-one

Drug info:

PubChemData

Smile

C(CN=[N+]=[N-])CBr

DOS

IR

Vibrations