Geometry & MOs

Info

ID:	83210
PubChem CID:	49857286
Reduced:	ON3C12H13 (1)
Stoich.:	AB3C12D13 (1)
Weight, g/mol:	290.153147
ΔH_f, kcal/mol:	18.43
Dipole, Da:	1.58
IP(EA), eV:	-8.97(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-(anilinomethyl)phenyl]methyl]pyrimidin-2-amine

Drug info:

PubChemData

Smile

C1=CN=C(N=C1)NCC2=CC=C(C=C2)CO

DOS

IR

Vibrations