Geometry & MOs

Info

ID:	296228
PubChem CID:	117561685
Reduced:	FN5H12C14 (1)
Stoich.:	AB5C12D14 (1)
Weight, g/mol:	284.06366
ΔH_f, kcal/mol:	58.02
Dipole, Da:	6.56
IP(EA), eV:	-9.23(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-tert-butyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-amine

Drug info:

PubChemData

Smile

C1CNCC2=C1N=C(N=C2NC3=CC(=CC=C3)F)C#N

DOS

IR

Vibrations