Geometry & MOs

Info

ID:	288363
PubChem CID:	104315648
Reduced:	BrN4C15H19 (1)
Stoich.:	AB4C15D19 (1)
Weight, g/mol:	399.97212
ΔH_f, kcal/mol:	53.03
Dipole, Da:	2.74
IP(EA), eV:	-9.19(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(3,5-dibromopyridin-2-yl)pyrimidin-5-yl]methyl]-2-methylpropan-2-amine

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)C2=NC=C(C=C2)Br)CNC(C)(C)C

DOS

IR

Vibrations