Geometry & MOs

Info

ID:	327715
PubChem CID:	126690844
Reduced:	OSC18H24 (1)
Stoich.:	ABC18D24 (1)
Weight, g/mol:	255.92642
ΔH_f, kcal/mol:	-39.19
Dipole, Da:	3.43
IP(EA), eV:	-8.36(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-6-(iodomethyl)-1,2-dihydropyrimidine

Drug info:

PubChemData

Smile

CCCCCSC1=CC=C(C2=CC=CC=C21)OC(C)C

DOS

IR

Vibrations