Geometry & MOs

Info

ID:	248710
PubChem CID:	103083821
Reduced:	BrIN3C13H13 (1)
Stoich.:	ABC3D13E13 (1)
Weight, g/mol:	320.06366
ΔH_f, kcal/mol:	66.82
Dipole, Da:	4.85
IP(EA), eV:	-9.11(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-bromo-2-methylphenyl)-6-propylpyrimidin-4-yl]hydrazine

Drug info:

PubChemData

Smile

CCNC1=NC(=NC=C1I)C2=C(C=C(C=C2)Br)C

DOS

IR

Vibrations