Geometry & MOs

Info

ID:	296550
PubChem CID:	117583203
Reduced:	N5C10H13 (1)
Stoich.:	A5B10C13 (1)
Weight, g/mol:	264.118653
ΔH_f, kcal/mol:	62.0
Dipole, Da:	1.83
IP(EA), eV:	-8.77(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(aminomethyl)-N-[(3,4-difluorophenyl)methyl]-N-methylpyrimidin-4-amine

Drug info:

PubChemData

Smile

C1=CNC(=C1)CNC2=NC(=NC=C2)CN

DOS

IR

Vibrations