Geometry & MOs

Info

ID:	263139
PubChem CID:	103341662
Reduced:	N2C15H20 (1)
Stoich.:	A2B15C20 (1)
Weight, g/mol:	207.019939
ΔH_f, kcal/mol:	29.94
Dipole, Da:	3.75
IP(EA), eV:	-8.28(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-6-(1H-pyrrol-2-yl)pyrimidine-5-carbaldehyde

Drug info:

PubChemData

Smile

CCCNC(C)C1=CC=CC=C1C2=CC=CN2

DOS

IR

Vibrations