Geometry & MOs

Info

ID:	207654
PubChem CID:	80433614
Reduced:	OBr2N2C14H16 (1)
Stoich.:	AB2C2D14E16 (1)
Weight, g/mol:	347.09971
ΔH_f, kcal/mol:	2.04
Dipole, Da:	5.28
IP(EA), eV:	-9.19(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-bromophenyl)-6-(2-methylpropyl)-N-propylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CC(C)CC1=C(C(=O)N(N1)CC2=CC=C(C=C2)Br)Br

DOS

IR

Vibrations