Geometry & MOs

Info

ID:	286876
PubChem CID:	104223336
Reduced:	O2N3C14H17 (1)
Stoich.:	A2B3C14D17 (1)
Weight, g/mol:	231.100777
ΔH_f, kcal/mol:	-15.52
Dipole, Da:	4.12
IP(EA), eV:	-9.46(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[5-(aminomethyl)pyrimidin-2-yl]oxyphenyl]methanol

Drug info:

PubChemData

Smile

CCNCC1=CN=C(N=C1)OC2=CC=CC=C2CO

DOS

IR

Vibrations