Geometry & MOs

Info

ID:	147624
PubChem CID:	53787280
Reduced:	N3O6C29H43 (1)
Stoich.:	A3B6C29D43 (1)
Weight, g/mol:	187.074562
ΔH_f, kcal/mol:	-257.8
Dipole, Da:	3.09
IP(EA), eV:	-8.31(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-methylpyrimidin-4-yl)pyridin-3-ol

Drug info:

PubChemData

Smile

CCOC(=O)CCCCCCC1=C(N(C(=O)N1NCC(C2CCCCC2)OC(=O)C)CC3=CC=CC=C3)O

DOS

IR

Vibrations