Geometry & MOs

Info

ID:	83209
PubChem CID:	49857284
Reduced:	FN2H8C9 (2)
Stoich.:	AB2C8D9 (2)
Weight, g/mol:	215.105862
ΔH_f, kcal/mol:	-7.34
Dipole, Da:	2.97
IP(EA), eV:	-8.89(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(pyrimidin-2-ylamino)methyl]phenyl]methanol

Drug info:

PubChemData

Smile

C1=CC(=NC(=C1)F)NCC2=CC=C(C=C2)CNC3=NC(=CC=C3)F

DOS

IR

Vibrations