Geometry & MOs

Info

ID:	279992
PubChem CID:	103846132
Reduced:	NC15H21 (1)
Stoich.:	AB15C21 (1)
Weight, g/mol:	203.051718
ΔH_f, kcal/mol:	8.11
Dipole, Da:	2.41
IP(EA), eV:	-8.09(0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methyl-4-pyridin-4-yl-1H-pyrimidine-2-thione

Drug info:

PubChemData

Smile

CC(C)C1=CC=CC=C1NC2CCCC=C2

DOS

IR

Vibrations