Geometry & MOs

Info

ID:	288193
PubChem CID:	104313366
Reduced:	BrN4C12H13 (1)
Stoich.:	AB4C12D13 (1)
Weight, g/mol:	264.00106
ΔH_f, kcal/mol:	57.95
Dipole, Da:	3.39
IP(EA), eV:	-8.86(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-bromopyridin-2-yl)-pyrimidin-5-ylmethanamine

Drug info:

PubChemData

Smile

CC1=C(C(=NC=C1)N)C(C2=C(C=CC=N2)Br)N

DOS

IR

Vibrations